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

*Links on SpectraBase are not permalinks.

[1R-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,8a.beta.,10a.alpha.)]-tetradecahydro-7-(1,1-ethylenedioxy)ethyl)-1,4a,7-trimethyl-8-oxo-1-phenanthrenecarboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

[1R-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,8a.beta.,10a.alpha.)]-tetradecahydro-7-(1,1-ethylenedioxy)ethyl)-1,4a,7-trimethyl-8-oxo-1-phenanthrenecarboxylic acid methyl ester
SpectraBase Compound ID J7tuK9JZxlz
InChI InChI=1S/C23H36O5/c1-20-10-6-11-21(2,19(25)26-5)17(20)8-7-15-16(20)9-12-22(3,18(15)24)23(4)27-13-14-28-23/h15-17H,6-14H2,1-5H3/t15-,16-,17+,20+,21+,22-/m1/s1
InChIKey WWXLIQREJQNCHU-GQLGQXKZSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 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 4pLgb8tt5Ph
Name [1R-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,8a.beta.,10a.alpha.)]-tetradecahydro-7-(1,1-ethylenedioxy)ethyl)-1,4a,7-trimethyl-8-oxo-1-phenanthrenecarboxylic acid methyl ester
Alternate Name(s) methyl (4alpha,5beta,9beta,10alpha,13beta)-13-methyl-13-(2-methyl-1,3-dioxolan-2-yl)-14-oxopodocarpan-15-oate
CAS Registry Number 125330-47-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-20-10-6-11-21(2,19(25)26-5)17(20)8-7-15-16(20)9-12-22(3,18(15)24)23(4)27-13-14-28-23/h15-17H,6-14H2,1-5H3/t15-,16-,17+,20+,21+,22-/m1/s1
InChIKey WWXLIQREJQNCHU-GQLGQXKZSA-N
Molecular Weight 392.536 g/mol
SMILES [C@]1(C([C@@]2(CC[C@]3([C@]([C@@]2(CC1)[H])(CCC[C@@]3(C(=O)OC)C)C)[H])[H])=O)(C1(OCCO1)C)C
SPLASH splash10-000i-9000000000-071b314a60439f7316b1
Source of Spectrum J-55-2372-5
Wiley ID 1365919