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3-cyclohexyl-2-benzothiopyran-1-one

View entire compound with spectra: 1 MS (GC)

3-cyclohexyl-2-benzothiopyran-1-one
SpectraBase Compound ID 1JvmqHdOQzQ
InChI InChI=1S/C15H16OS/c16-15-13-9-5-4-8-12(13)10-14(17-15)11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7H2
InChIKey IGFUKCYNGALIFX-UHFFFAOYSA-N
Mol Weight 244.35 g/mol
Molecular Formula C15H16OS
Exact Mass 244.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ADqW9eRpMm
Name 3-cyclohexyl-2-benzothiopyran-1-one
Alternate Name(s) 3-cyclohexylisothiochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16OS
InChI InChI=1S/C15H16OS/c16-15-13-9-5-4-8-12(13)10-14(17-15)11-6-2-1-3-7-11/h4-5,8-11H,1-3,6-7H2
InChIKey IGFUKCYNGALIFX-UHFFFAOYSA-N
Molecular Weight 244.352 g/mol
SMILES C1(=Cc2c(C(S1)=O)cccc2)C1CCCCC1
SPLASH splash10-00r6-0690000000-a3ef4eee9c3838f3bd53
Source of Spectrum SO-0-1134-4
Wiley ID 1541844