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2H-1-Benzothiopyran-4-carbonitrile, 3,4-dihydro-3,3-dimethyl-
SpectraBase Compound ID 6rNwlQ7e3nE
InChI InChI=1S/C12H13NS/c1-12(2)8-14-11-6-4-3-5-9(11)10(12)7-13/h3-6,10H,8H2,1-2H3
InChIKey UELNBEVFNFDKTL-UHFFFAOYSA-N
Mol Weight 203.3 g/mol
Molecular Formula C12H13NS
Exact Mass 203.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xBrr4y1aiF
Name 2H-1-Benzothiopyran-4-carbonitrile, 3,4-dihydro-3,3-dimethyl-
CAS Registry Number 120783-36-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NS
InChI InChI=1S/C12H13NS/c1-12(2)8-14-11-6-4-3-5-9(11)10(12)7-13/h3-6,10H,8H2,1-2H3
InChIKey UELNBEVFNFDKTL-UHFFFAOYSA-N
Molecular Weight 203.303 g/mol
SMILES C1(c2c(cccc2)SCC1(C)C)C#N
SPLASH splash10-0udj-0890000000-c7c504f3818822a78cdc
Source of Spectrum KC-1988-3379-9
Synonyms 3,3-Dimethyl-3,4-dihydro-2H-1-benzothiopyran-4-carbonitrile 3,3-Dimethylthiochroman-4-carbomitrile 3,3-Dimethyl-2,4-dihydro-1-benzothiopyran-4-carbonitrile 3,3-Dimethylthiochromane-4-carbonitrile 3,3-Dimethyl-2,4-dihydrothiochromene-4-carbonitrile
Wiley ID 1200933