benzothiazole (Q419096)

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).

Aspalathus linearis

1 reference

Volatile components of Rooibos tea (Aspalathus linearis)

Litchi chinensis

1 reference

Volatile constituents of litchi (Litchi chinesis Sonn.)

star fruit

1 reference

Volatile constituents of carambola (Averrhoa carambola L.)

Basella alba

1 reference

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

Brassica carinata

2 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

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.

Onion

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

Bulbophyllum variegatum

1 reference

Sapromyiophily in the native orchid, Bulbophyllum variegatum, on Réunion (Mascarene Archipelago, Indian Ocean)

mass

135.014 dalton

1 reference

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

BENZOTHIAZOLE (English)

6 October 2016

0 references

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Benzothiazole

0 references

Identifiers

InChI

1 reference

BENZOTHIAZOLE (English)

6 October 2016

2 references

BENZOTHIAZOLE (English)

6 October 2016

ChEBI release 2020-09-01

2 references

benzothiazole (English)

6 October 2016

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

9 April 2021

1 reference

1,3-Benzothiazole (English)

6 October 2016

2 references

BENZOTHIAZOLE (English)

6 October 2016

Reaxys registry number

109468

1 reference

benzothiazole (English)

6 October 2016

ChEBI ID

45993

mapping relation type

2 references

benzothiazole (English)

6 October 2016

International Chemical Identifier

InChI

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

1 reference

BENZO[D]THIAZOLE (English)

6 October 2016

2 references

inferred from InChIKey

MSBNK-Athens_Univ-AU405606

1 reference

MassBank accession ID

0 references

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0 references

0 references

0 references

0 references

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MSBNK-Athens_Univ-AU405608

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MSBNK-Fac_Eng_Univ_Tokyo-JP000473

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP012060

0 references

MSBNK-UFZ-UF420801

0 references

MSBNK-UFZ-UF420802

0 references

MSBNK-UFZ-UF420803

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MSBNK-Fac_Eng_Univ_Tokyo-JP008217

0 references

SPLASH

splash10-000i-0900000000-23187027d5c1a229f442

0 references

splash10-000i-0900000000-cdfc15b55d3e2a90e644

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splash10-000i-0900000000-23e0e49d7d7a2ac95443

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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

0 references

splash10-000i-0900000000-f971eedbdb355ab4b11c

0 references

splash10-000i-6900000000-101b2ad37661f6438179

0 references

splash10-000i-2900000000-ac6acb266d8c21f1c542

0 references

splash10-000i-2900000000-295f818bb85918e8d003

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splash10-000i-0900000000-ce77248d1c86827d67a3

0 references

splash10-000i-0900000000-eb6332ab9322a7dd166d

0 references

splash10-000i-0900000000-76a6050548e54cc4c4b6

0 references

splash10-000i-0900000000-69af903dce2e39b4ebfd

0 references

splash10-000i-7900000000-b40f6615eb822769c665

0 references

NMRShiftDB structure ID

10023372

1 reference

Hazardous Substances Data Bank

0 references

1 reference

28 October 2019

BENZOTHIAZOLE (English)

10 May 2021

2 references

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

DSSTOX compound identifier

0 references

0 references

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

Human Metabolome Database ID

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

HMDB0032930

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00052216

2 references

based on heuristic

inferred from InChIKey

UNII

G5BW2593EP

2 references

Global Substance Registration System

UNII

G5BW2593EP

BENZOTHIAZOLE (English)

6 October 2016

Immune Epitope Database and Analysis Resource

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)