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

*Links on SpectraBase are not permalinks.
Lobatin-B
SpectraBase Compound ID 9qzT5j05bGw
InChI InChI=1S/C20H24O7/c1-9(2)6-15(22)26-17-16-11(4)19(24)25-13(16)7-10(3)12-8-14(21)20(5,27-12)18(17)23/h7-9,13,16-18,23H,4,6H2,1-3,5H3/b10-7-/t13?,16?,17?,18?,20-/m0/s1
InChIKey JXMKTEYFXIBRKC-VWWJCYITSA-N
Mol Weight 376.41 g/mol
Molecular Formula C20H24O7
Exact Mass 376.152203 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 6SmCpOb49IV
Name Lobatin-B
CAS Registry Number 84754-02-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O7
InChI InChI=1S/C20H24O7/c1-9(2)6-15(22)26-17-16-11(4)19(24)25-13(16)7-10(3)12-8-14(21)20(5,27-12)18(17)23/h7-9,13,16-18,23H,4,6H2,1-3,5H3/b10-7-/t13?,16?,17?,18?,20-/m0/s1
InChIKey JXMKTEYFXIBRKC-VWWJCYITSA-N
Molecular Weight 376.405 g/mol
SMILES OC1C(OC(CC(C)C)=O)C2C(C(OC2\C=C/(C=2O[C@@]1(C)C(C2)=O)C)=O)=C
SPLASH splash10-03di-7910000000-896a6130e08983e80c48
Source of Spectrum W5-1989-35314-30222
Synonyms Butanoic acid, 3-methyl-, (3aS,4S,5R,6R,10Z,11aR)-2,3,3a,4,5,6,7,11a-octahydro-5-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca(b)furan-4-yl ester
Wiley ID 1357671