For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,5,6,7,8,8a-Hexahydro-3-methyl-1-phenyl-1H-[2]benzothiopyran
SpectraBase Compound ID BakfUjrT0Vz
InChI InChI=1S/C16H20S/c1-12-11-14-9-5-6-10-15(14)16(17-12)13-7-3-2-4-8-13/h2-4,7-8,11-12,15-16H,5-6,9-10H2,1H3
InChIKey ZFKOFVQIPLABMT-UHFFFAOYSA-N
Mol Weight 244.4 g/mol
Molecular Formula C16H20S
Exact Mass 244.128572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IxNEQpR1R81
Name 3,5,6,7,8,8a-Hexahydro-3-methyl-1-phenyl-1H-[2]benzothiopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20S
InChI InChI=1S/C16H20S/c1-12-11-14-9-5-6-10-15(14)16(17-12)13-7-3-2-4-8-13/h2-4,7-8,11-12,15-16H,5-6,9-10H2,1H3
InChIKey ZFKOFVQIPLABMT-UHFFFAOYSA-N
Molecular Weight 244.396 g/mol
SMILES C=12C(C(c3ccccc3)SC(C1)C)CCCC2
SPLASH splash10-00ke-2900000000-8aaf14f9c54988cad516
Source of Spectrum AC-1990-243-5
Synonyms 3-Methyl-1-phenyl-3,5,6,7,8,8a-hexahydro-1H-2-benzothiopyran
Wiley ID 747835