benzothiazole (Q419096)

BENZOTHIAZOLE (English)

6 October 2016

chemical formula

C₇H₅NS

1 reference

BENZOTHIAZOLE (English)

6 October 2016

canonical SMILES

C1=CC=C2C(=C1)N=CS2

1 reference

BENZOTHIAZOLE (English)

6 October 2016

melting point

2 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

Psidium guajava

1 reference

The Occurrence of Pentane-2-Thiol in Guava Fruit

Zingiber mioga

1 reference

Volatile Flavor Compounds of Myoga (Zingiber Mioga).

rooibos

1 reference

Volatile components of Rooibos tea (Aspalathus linearis)

Litchi chinensis

1 reference

Volatile constituents of litchi (Litchi chinesis Sonn.)

starfruit

1 reference

Volatile constituents of carambola (Averrhoa carambola L.)

Basella alba

1 reference

Volatile flavor components of malabar-nightshade (Basella rubra L.)

Brassica carinata

3 references

Headspace volatiles of whole plants and macerated plant parts of Brassica and Sinapis

Headspace volatiles of whole plants and macerated plant parts of Brassica and Sinapis

Headspace volatiles of whole plants and macerated plant parts of Brassica and Sinapis

Camellia sinensis

2 references

New volatile constituents of black tea aroma

Metabolite profiling of Camellia sinensis by automated sequential, multidimensional gas chromatography/mass spectrometry reveals strong monsoon effects on tea constituents

Festuca arundinacea

1 reference

Composition of essential oil of tall fescue

Freesia hybrida

1 reference

The volatile constituents of freesia flower (Freesia hybrida Hort.).

Gossypium hirsutum

1 reference

Survey of the volatile constituents of cotton lint and waste with regard to byssinosis

Gymnodinium nagasakiense

1 reference

Cell-destroying sesquiterpenoid from red tide of Gymnodinium nagasakiense

Polygala senega

1 reference

Volatile compounds ofPolygala senega L. var.latifolia Torrey et Gray roots

Porphyra tenera

1 reference

Volatile compounds and long-chain aldehydes formation in conchocelis-filaments of a red alga, Porphyra tenera

Vaccinium macrocarpon

1 reference

The Aroma of Cranberries. II. Vaccinium macrocarpon Ait.

Allium cepa

1 reference

Chemical compositions and antioxidant/anti-inflammatory activities of steam distillate from freeze-dried onion ( Allium cepa L.) sprout

Carica papaya

1 reference

Volatile components of papaya (Carica papaya L., Solo variety)

Durio zibethinus

1 reference

Sulfur-Containing Volatiles of Durian Fruits (Durio zibethinus Murr.)

Nicotiana tabacum

2 references

A Chemical Study of Burley Tobacco Flavour (Nicotiana tabacum L.). I. Volatile to medium-volatile constituents (b.p. ≦ 84°/0.001 Torr

Comparison of different extraction methods: steam distillation, simultaneous distillation and extraction and headspace co-distillation, used for the analysis of the volatile components in aged flue-cured tobacco leaves

Karenia mikimotoi

1 reference

Cell-destroying sesquiterpenoid from red tide of Gymnodinium nagasakiense

Festuca rubra

1 reference

Composition of essential oil of tall fescue

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Benzothiazole

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Identifiers

InChI

InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H

1 reference

BENZOTHIAZOLE (English)

IOJUPLGTWVMSFF-UHFFFAOYSA-N

6 October 2016

InChIKey

2 references

BENZOTHIAZOLE (English)

6 October 2016

ChEBI release 2020-09-01

2 references

benzothiazole (English)

IOJUPLGTWVMSFF-UHFFFAOYSA-N

6 October 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=95-16-9

1 reference

1,3-Benzothiazole (English)

6 October 2016

1 reference

BENZOTHIAZOLE (English)

6 October 2016

Reaxys registry number

109468

1 reference

benzothiazole (English)

6 October 2016

ChEBI ID

45993

mapping relation type

1 reference

benzothiazole (English)

6 October 2016

1 reference

MSBNK-Athens_Univ-AU405606

BENZO[D]THIAZOLE (English)

6 October 2016

1 reference

inferred from InChIKey

1 reference

MassBank accession ID

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MSBNK-Athens_Univ-AU405608

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MSBNK-Fac_Eng_Univ_Tokyo-JP000473

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MSBNK-Fac_Eng_Univ_Tokyo-JP012060

0 references

MSBNK-UFZ-UF420801

0 references

MSBNK-UFZ-UF420802

0 references

MSBNK-UFZ-UF420803

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008217

0 references

SPLASH

splash10-000i-0900000000-23187027d5c1a229f442

0 references

splash10-000i-0900000000-cdfc15b55d3e2a90e644

0 references

splash10-000i-0900000000-23e0e49d7d7a2ac95443

0 references

splash10-000i-0900000000-e6818e8bda3c62c04253

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splash10-000i-0900000000-df0660c0ba3ed7847630

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splash10-000i-0900000000-4b35b950d90ba8676be9

0 references

splash10-000i-0900000000-f93a8a628d80521ad5b8

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splash10-000i-0900000000-f971eedbdb355ab4b11c

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splash10-000i-6900000000-101b2ad37661f6438179

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splash10-000i-2900000000-ac6acb266d8c21f1c542

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splash10-000i-2900000000-295f818bb85918e8d003

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splash10-000i-0900000000-ce77248d1c86827d67a3

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splash10-000i-0900000000-eb6332ab9322a7dd166d

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splash10-000i-0900000000-76a6050548e54cc4c4b6

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splash10-000i-0900000000-69af903dce2e39b4ebfd

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splash10-000i-7900000000-b40f6615eb822769c665

0 references

0 references

1 reference

Hazardous Substances Data Bank

28 October 2019

BENZOTHIAZOLE (English)

10 May 2021

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

202-396-2

1 reference

Global Substance Registration System

UNII

G5BW2593EP

BENZOTHIAZOLE (English)

ECHA Substance Infocard ID

6 October 2016

100.002.179

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.002.179

27 December 2018

AICS Chemical ID (BEING DELETED)

Benzothiazole (English)

quotation

CAS no.: 95-16-9 (English)

FL number

15.016

1 reference

quotation

CAS no.: 95-16-9 (English)

23 January 2021

15.016

1 reference

28 December 2019

BENZOTHIAZOLE (English)

quotation

CAS no.: 95-16-9 (English)

UM-BBD compound ID

c1128

0 references

1841

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Human Metabolome Database ID

HMDB0032930

1 reference

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00052216

1 reference

based on heuristic

inferred from InChIKey

UNII

G5BW2593EP

1 reference

Global Substance Registration System

UNII

G5BW2593EP

Immune Epitope Database and Analysis Resource

BENZOTHIAZOLE (English)

6 October 2016

0 references

1 reference

1 March 2022

1 reference

28 October 2013

1040

1 reference

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)