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N-((2E)-3-Methyl-1,3-benzothiazol-2(3H)-ylidene)ethanethioamide
SpectraBase Compound ID CFrfcwxXYak
InChI InChI=1S/C10H10N2S2/c1-7(13)11-10-12(2)8-5-3-4-6-9(8)14-10/h3-6H,1-2H3/b11-10-
InChIKey NCIRZCJIUTXRQE-KHPPLWFESA-N
Mol Weight 222.32 g/mol
Molecular Formula C10H10N2S2
Exact Mass 222.028541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjRiu1GH4Kq
Name N-((2E)-3-Methyl-1,3-benzothiazol-2(3H)-ylidene)ethanethioamide
Alternate Name(s) 2-Thioacetylimino-3-methyl-2,3-dihydrobenzothiazole
CAS Registry Number 64949-42-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N2S2
InChI InChI=1S/C10H10N2S2/c1-7(13)11-10-12(2)8-5-3-4-6-9(8)14-10/h3-6H,1-2H3/b11-10-
InChIKey NCIRZCJIUTXRQE-KHPPLWFESA-N
Molecular Weight 222.324 g/mol
SMILES CN1\C(Sc2ccccc12)=N\C(C)=S
SPLASH splash10-00di-0290000000-bd693abb5024bb174376
Source of Spectrum O-24-890-4
Wiley ID 1221874