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3-[(1S,6R)-6-(p-Tolylsulfonyl)bicyclo[4.1.0]hept-1-yl]propanol
SpectraBase Compound ID Bl6uY2BSlmP
InChI InChI=1S/C17H24O3S/c1-14-5-7-15(8-6-14)21(19,20)17-11-3-2-9-16(17,13-17)10-4-12-18/h5-8,18H,2-4,9-13H2,1H3/t16-,17+/m0/s1
InChIKey GWHXIPKXIMGLBC-DLBZAZTESA-N
Mol Weight 308.44 g/mol
Molecular Formula C17H24O3S
Exact Mass 308.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYN2xBvUyN4
Name 3-[(1S,6R)-6-(p-Tolylsulfonyl)bicyclo[4.1.0]hept-1-yl]propanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3S
InChI InChI=1S/C17H24O3S/c1-14-5-7-15(8-6-14)21(19,20)17-11-3-2-9-16(17,13-17)10-4-12-18/h5-8,18H,2-4,9-13H2,1H3/t16-,17+/m0/s1
InChIKey GWHXIPKXIMGLBC-DLBZAZTESA-N
Molecular Weight 308.436 g/mol
SMILES OCCC[C@]12[C@](S(c3ccc(cc3)C)(=O)=O)(C1)CCCC2
SPLASH splash10-000i-0900000000-556ec34b8a68a20afffb
Source of Spectrum E1-43-576-23
Synonyms 3-{(1S,6R)-6-[(4-methylphenyl)sulfonyl]bicyclo[4.1.0]hept-1-yl}-1-propanol
Wiley ID 1553007