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3-Cyano-3,4,5,6-tetrahydro-4-phenylthio-2H-naphtho[1,2-b]thiopyran
SpectraBase Compound ID IisgcyVGyCB
InChI InChI=1S/C20H17NS2/c21-12-15-13-22-20-17-9-5-4-6-14(17)10-11-18(20)19(15)23-16-7-2-1-3-8-16/h1-9,15,19H,10-11,13H2
InChIKey GKVJARRYQGWGRU-UHFFFAOYSA-N
Mol Weight 335.48 g/mol
Molecular Formula C20H17NS2
Exact Mass 335.080242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxZbuNz6Oyy
Name 3-Cyano-3,4,5,6-tetrahydro-4-phenylthio-2H-naphtho[1,2-b]thiopyran
Alternate Name(s) 4-(Phenylsulfanyl)-3,4,5,6-tetrahydro-2H-naphtho[1,2-b]thiopyran-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17NS2
InChI InChI=1S/C20H17NS2/c21-12-15-13-22-20-17-9-5-4-6-14(17)10-11-18(20)19(15)23-16-7-2-1-3-8-16/h1-9,15,19H,10-11,13H2
InChIKey GKVJARRYQGWGRU-UHFFFAOYSA-N
Molecular Weight 335.483 g/mol
SMILES C12=C(SCC(C2Sc2ccccc2)C#N)c2ccccc2CC1
SPLASH splash10-004i-0981000000-c47609be4824ec2f31e2
Source of Spectrum AJ-65-2059-2
Wiley ID 771483