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

*Links on SpectraBase are not permalinks.
Propanoic acid, 2-methyl-, 2,3,3a,4,5,8,9,10,11,11a-decahydro-6,10-dimethyl-3-methylene-2,9-diox ocyclodeca[b]furan-4-yl ester, [3aS-(3aR*,4S*,6Z,10R*,11aS*)]-
SpectraBase Compound ID HQBS5C0kKhG
InChI InChI=1S/C19H26O5/c1-10(2)18(21)23-15-8-11(3)6-7-14(20)12(4)9-16-17(15)13(5)19(22)24-16/h6,10,12,15-17H,5,7-9H2,1-4H3/b11-6-/t12-,15+,16+,17+/m0/s1
InChIKey TYLYJXLPVLEKQW-JRGVBLOJSA-N
Mol Weight 334.41 g/mol
Molecular Formula C19H26O5
Exact Mass 334.178024 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 FuyPaXHErcw
Name Propanoic acid, 2-methyl-, 2,3,3a,4,5,8,9,10,11,11a-decahydro-6,10-dimethyl-3-methylene-2,9-diox ocyclodeca[b]furan-4-yl ester, [3aS-(3aR*,4S*,6Z,10R*,11aS*)]-
CAS Registry Number 88555-90-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O5
InChI InChI=1S/C19H26O5/c1-10(2)18(21)23-15-8-11(3)6-7-14(20)12(4)9-16-17(15)13(5)19(22)24-16/h6,10,12,15-17H,5,7-9H2,1-4H3/b11-6-/t12-,15+,16+,17+/m0/s1
InChIKey TYLYJXLPVLEKQW-JRGVBLOJSA-N
Molecular Weight 334.412 g/mol
SMILES C1(C([C@@]2([C@](OC(=O)C(C)C)(C\C(=C/CC([C@](C[C@]2(O1)[H])(C)[H])=O)C)[H])[H])=C)=O
SPLASH splash10-0002-1191000000-4acd4615ecfbf2f00298
Source of Spectrum F-39-2843-0
Synonyms (3aS,4R,10S,11aR)-6,10-dimethyl-3-methylene-2,9-dioxo-2,3,3a,4,5,8,9,10,11,11a-decahydrocyclodeca[b]furan-4-yl 2-methylpropanoate Cyclodeca[b]furan, propanoic acid deriv. Dideoxy derivative of tagitinin A
Wiley ID 1330970