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2,6-Dimethyl-2-phenylthiomethyl-7-(tetrahydropyranyl)bicyclo[4.3.0]non-1(9)-en-3-one
SpectraBase Compound ID 3rl3CFiO51e
InChI InChI=1S/C23H30O3S/c1-22-14-13-19(24)23(2,16-27-17-8-4-3-5-9-17)18(22)11-12-20(22)26-21-10-6-7-15-25-21/h3-5,8-9,11,20-21H,6-7,10,12-16H2,1-2H3
InChIKey CPLWTZRCFPGDOK-UHFFFAOYSA-N
Mol Weight 386.55 g/mol
Molecular Formula C23H30O3S
Exact Mass 386.191566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID zfOnAsdz9h
Name 2,6-Dimethyl-2-phenylthiomethyl-7-(tetrahydropyranyl)bicyclo[4.3.0]non-1(9)-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O3S
InChI InChI=1S/C23H30O3S/c1-22-14-13-19(24)23(2,16-27-17-8-4-3-5-9-17)18(22)11-12-20(22)26-21-10-6-7-15-25-21/h3-5,8-9,11,20-21H,6-7,10,12-16H2,1-2H3
InChIKey CPLWTZRCFPGDOK-UHFFFAOYSA-N
Molecular Weight 386.550 g/mol
SMILES C=12C(C(=O)CCC2(C(OC2OCCCC2)CC1)C)(CSc1ccccc1)C
SPLASH splash10-0079-3912000000-a7e33721ae501bc79ee9
Source of Spectrum QE-4-1485-14
Synonyms 2,6-Dimethyl-2-phenylthiomethyl-7-(tetrahydropyranyloxy)bicyclo[4.3.0]non-1(9)-en-3-one
Wiley ID 843709