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

*Links on SpectraBase are not permalinks.
PENTANDRANOIC-ACID-C;3-ALPHA-HYDROXY-12-OXO-CLERODA-4(18),13(16)-DIEN-15-OIC-ACID
SpectraBase Compound ID 8Vd36z3aHKk
InChI InChI=1S/C20H30O4/c1-12(10-18(23)24)16(22)11-20(5)13(2)8-9-19(4)14(3)15(21)6-7-17(19)20/h13,15,17,21H,1,3,6-11H2,2,4-5H3,(H,23,24)/t13-,15-,17+,19+,20+/m1/s1
InChIKey AXFOKPPCLGXPNK-UJSLSXSBSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 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 QwzRJaqgK
Name 3-[2-[(1S,2R,4aR,6R,8aR)-6-hydroxy-1,2,4a-trimethyl-5-methylene-decalin-1-yl]acetyl]but-3-enoic acid
Alternate Name(s) 5-[(1S,2R,4aR,6R,8aR)-1,2,4a-trimethyl-5-methylidene-6-oxidanyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylidene-4-oxidanylidene-pentanoic acid 5-[(1S,2R,4aR,6R,8aR)-6-hydroxy-1,2,4a-trimethyl-5-methylene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylene-4-oxopentanoic acid 5-[(1S,2R,4aR,6R,8aR)-6-hydroxy-1,2,4a-trimethyl-5-methylene-decalin-1-yl]-3-methylene-4-oxo-pentanoic acid 5-[(1S,2R,4aR,6R,8aR)-6-hydroxy-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylidene-4-oxopentanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-12(10-18(23)24)16(22)11-20(5)13(2)8-9-19(4)14(3)15(21)6-7-17(19)20/h13,15,17,21H,1,3,6-11H2,2,4-5H3,(H,23,24)/t13-,15-,17+,19+,20+/m1/s1
InChIKey AXFOKPPCLGXPNK-UJSLSXSBSA-N
Molecular Weight 334.456 g/mol
SMILES O[C@@]1(CC[C@@]2([C@@](CC(C(CC(=O)O)=C)=O)([C@@](CC[C@]2(C1=C)C)(C)[H])C)[H])[H]
SPLASH splash10-0avi-4941000000-b367de1f8072476fcff0
Source of Spectrum G4-63-1064-3
Wiley ID 1608549