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2,5-Dimethylbenzothiazole
SpectraBase Compound ID DOalj5ZveLi
InChI InChI=1S/C9H9NS/c1-6-3-4-9-8(5-6)10-7(2)11-9/h3-5H,1-2H3
InChIKey XHANCLXYCNTZMM-UHFFFAOYSA-N
Mol Weight 163.24 g/mol
Molecular Formula C9H9NS
Exact Mass 163.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEuFTdxl2Mw
Name Benzothiazole, 2,5-dimethyl-
CAS Registry Number 95-26-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NS
InChI InChI=1S/C9H9NS/c1-6-3-4-9-8(5-6)10-7(2)11-9/h3-5H,1-2H3
InChIKey XHANCLXYCNTZMM-UHFFFAOYSA-N
Molecular Weight 163.238 g/mol
SMILES Cc1ccc2c(c1)nc(C)s2
SPLASH splash10-03k9-9700000000-02048d84d2bb6dab0f98
Source of Spectrum W6-9512-0-0
Synonyms 2,5-Dimethyl-1,3-benzothiazole 2,5-Dimethylbenzothiazole 2,5-Dimethylbenzthiazol BRN 0116455 EINECS 202-404-4
Wiley ID 13537