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

*Links on SpectraBase are not permalinks.
(4aS,10aR)-7-isopropyl-8-methoxy-4a-methyl-1-methylene-3,4,4a,9,10,10a-hexahydrophenanthren-2(1H)-one
SpectraBase Compound ID GRQFnrUdmsK
InChI InChI=1S/C20H26O2/c1-12(2)14-6-9-17-15(19(14)22-5)7-8-16-13(3)18(21)10-11-20(16,17)4/h6,9,12,16H,3,7-8,10-11H2,1-2,4-5H3/t16-,20-/m0/s1
InChIKey CRUJDBOJVHPTJY-JXFKEZNVSA-N
Mol Weight 298.43 g/mol
Molecular Formula C20H26O2
Exact Mass 298.19328 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 KtxZHiw5AMQ
Name (4aS,10aR)-7-isopropyl-8-methoxy-4a-methyl-1-methylene-3,4,4a,9,10,10a-hexahydrophenanthren-2(1H)-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O2
InChI InChI=1S/C20H26O2/c1-12(2)14-6-9-17-15(19(14)22-5)7-8-16-13(3)18(21)10-11-20(16,17)4/h6,9,12,16H,3,7-8,10-11H2,1-2,4-5H3/t16-,20-/m0/s1
InChIKey CRUJDBOJVHPTJY-JXFKEZNVSA-N
Molecular Weight 298.426 g/mol
SMILES [C@]12(c3c(c(OC)c(cc3)C(C)C)CC[C@]1(C(=C)C(CC2)=O)[H])C
SPLASH splash10-0007-0090000000-7e656dc3cb5707e2d798
Source of Spectrum F-67-906-7
Synonyms (4aS,10aR)-8-methoxy-4a-methyl-1-methylene-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one (4aS,10aR)-8-methoxy-4a-methyl-1-methylidene-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one
Wiley ID 1685628