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

*Links on SpectraBase are not permalinks.
(4R)-4-{4-[1-(1,2-cis-Hexen-1-yl)cyclobutyl]-2,6-dihydroxyphenyl}-6,6-dimethyl-2-norpinanone
SpectraBase Compound ID CUfV0NfLOVm
InChI InChI=1S/C25H34O3/c1-4-5-6-7-9-25(10-8-11-25)16-12-21(27)23(22(28)13-16)17-14-20(26)19-15-18(17)24(19,2)3/h7,9,12-13,17-19,27-28H,4-6,8,10-11,14-15H2,1-3H3/b9-7-/t17-,18-,19+/m1/s1
InChIKey MQMNTLKLPTXWRH-TXKZITIOSA-N
Mol Weight 382.5 g/mol
Molecular Formula C25H34O3
Exact Mass 382.250795 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 L0f2t3Y69Cu
Name (4R)-4-{4-[1-(1,2-cis-Hexen-1-yl)cyclobutyl]-2,6-dihydroxyphenyl}-6,6-dimethyl-2-norpinanone
Appearance White crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O3
InChI InChI=1S/C25H34O3/c1-4-5-6-7-9-25(10-8-11-25)16-12-21(27)23(22(28)13-16)17-14-20(26)19-15-18(17)24(19,2)3/h7,9,12-13,17-19,27-28H,4-6,8,10-11,14-15H2,1-3H3/b9-7-/t17-,18-,19+/m1/s1
InChIKey MQMNTLKLPTXWRH-TXKZITIOSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jm100641g
Molecular Weight 382.544 g/mol
SMILES Oc1c(c(cc(c1)C1(\C=C/CCCC)CCC1)O)[C@@]1(CC([C@@]2(C[C@]1(C2(C)C)[H])[H])=O)[H]
SPLASH splash10-001i-2239000000-acad7c6e04de08ca8b61
Source of Spectrum AF-53-7003-5d
Wiley ID 1846298