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(2S,9S,10S)-6-Methyl-7-tert-butoxy-4-hydroxybicyclo[4.4.0]dec-1-en-3-one isomer

View entire compound with spectra: 1 MS (GC)

(2S,9S,10S)-6-Methyl-7-tert-butoxy-4-hydroxybicyclo[4.4.0]dec-1-en-3-one isomer
SpectraBase Compound ID 4W9CfEIWUXF
InChI InChI=1S/C15H24O3/c1-14(2,3)18-13-7-5-6-10-8-11(16)12(17)9-15(10,13)4/h8,12-13,17H,5-7,9H2,1-4H3/t12-,13-,15-/m0/s1
InChIKey VVCNJNMKWWMHSW-YDHLFZDLSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EzZtsc57kL
Name (2S,9S,10S)-6-Methyl-7-tert-butoxy-4-hydroxybicyclo[4.4.0]dec-1-en-3-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-14(2,3)18-13-7-5-6-10-8-11(16)12(17)9-15(10,13)4/h8,12-13,17H,5-7,9H2,1-4H3/t12-,13-,15-/m0/s1
InChIKey VVCNJNMKWWMHSW-YDHLFZDLSA-N
Molecular Weight 252.354 g/mol
SMILES O[C@@]1(C(=O)C=C2[C@](C1)([C@@](OC(C)(C)C)(CCC2)[H])C)[H]
SPLASH splash10-0002-0900000000-067db4056a0ee792c097
Source of Spectrum F-50-8423-24
Synonyms (4S,6S,7S)-6-Methyl-7-tert-butoxy-4-hydroxybicyclo[4.4.0]dec-1-en-3-one
Wiley ID 1255971