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Benzothiazole
SpectraBase Compound ID 8wOdVvIqVx5
InChI InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H
InChIKey IOJUPLGTWVMSFF-UHFFFAOYSA-N
Mol Weight 135.18 g/mol
Molecular Formula C7H5NS
Exact Mass 135.01427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPniqcbecb1
Name Benzosulfonazole
Source of Sample SAFC Cat.no. W325600
CAS Registry Number 95-16-9
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 135.014270339 u
Formula C7H5NS
InChI InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H
InChIKey IOJUPLGTWVMSFF-UHFFFAOYSA-N
Molecular Weight 135.184 g/mol
Number of Peaks 50
RI1 1226
RI2 904
RI3 1324
RI4 1285
RI5 1424
SMILES c1sc2c(n1)cccc2
SPLASH splash10-052r-8900000000-1bae504e42cc207771c2
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzothiazole
Wiley ID LM_FFNSC3_24