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

*Links on SpectraBase are not permalinks.

Methyl 13-(2'-oxopropyl)podocarpa-8,11,13-trien-16-oate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Methyl 13-(2'-oxopropyl)podocarpa-8,11,13-trien-16-oate
SpectraBase Compound ID 3XKOpj8UdS6
InChI InChI=1S/C21H28O3/c1-14(22)12-15-6-8-17-16(13-15)7-9-18-20(17,2)10-5-11-21(18,3)19(23)24-4/h6,8,13,18H,5,7,9-12H2,1-4H3/t18?,20-,21+/m1/s1
InChIKey IPPXYRAIQJTKDF-HBYOEVMUSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FjEtb1LOzFG
Name Methyl 13-(2'-oxopropyl)podocarpa-8,11,13-trien-16-oate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.203844759 u
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-14(22)12-15-6-8-17-16(13-15)7-9-18-20(17,2)10-5-11-21(18,3)19(23)24-4/h6,8,13,18H,5,7,9-12H2,1-4H3/t18?,20-,21+/m1/s1
InChIKey IPPXYRAIQJTKDF-HBYOEVMUSA-N
Molecular Weight 328.452 g/mol
SMILES [C@@]12(C([C@](C(=O)OC)(C)CCC2)CCC2=C1C=CC(CC(=O)C)=C2)C