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

*Links on SpectraBase are not permalinks.
METHYL-O-METHYL-PISIFERATE
SpectraBase Compound ID 4dGHrgHLt6O
InChI InChI=1S/C22H32O3/c1-14(2)16-12-15-8-9-19-21(3,4)10-7-11-22(19,20(23)25-6)17(15)13-18(16)24-5/h12-14,19H,7-11H2,1-6H3/t19-,22-/m0/s1
InChIKey OTVSVVDNOOVYKN-UGKGYDQZSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 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 9FUkfas4NgG
Name (4aR,10aS)-6-methoxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid methyl ester
CAS Registry Number 110716-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-14(2)16-12-15-8-9-19-21(3,4)10-7-11-22(19,20(23)25-6)17(15)13-18(16)24-5/h12-14,19H,7-11H2,1-6H3/t19-,22-/m0/s1
InChIKey OTVSVVDNOOVYKN-UGKGYDQZSA-N
Molecular Weight 344.495 g/mol
SMILES [C@]12(c3c(cc(c(c3)OC)C(C)C)CC[C@]1(C(C)(C)CCC2)[H])C(=O)OC
SPLASH splash10-000l-0194000000-5cf8012db4176aec990e
Source of Spectrum F-42-5537-1
Synonyms (4aR,10aS)-7-isopropyl-6-methoxy-1,1-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid methyl ester Methyl (4aR,10aS)-6-methoxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylate Methyl (4aR,10aS)-7-isopropyl-6-methoxy-1,1-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylate Methyl 12-methoxyabieta-8,11,13-trien-20-oate
Wiley ID 1338265