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2-Pentenoic acid, 5-[6-(acetyloxy)decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-3-methyl-, [1S-(1.alpha.,4a.beta.,6.alpha.,8a.alpha.)]-
SpectraBase Compound ID Hw3PcyDbLqA
InChI InChI=1S/C22H34O4/c1-14(13-20(24)25)7-9-17-15(2)8-10-18-21(4,5)19(26-16(3)23)11-12-22(17,18)6/h13,17-19H,2,7-12H2,1,3-6H3,(H,24,25)/b14-13+/t17-,18+,19+,22-/m0/s1
InChIKey OMNJRQNCWHCCBZ-RRFUJITQSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dwGDwB9MBI
Name 2-Pentenoic acid, 5-[6-(acetyloxy)decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]-3-methyl-, [1S-(1.alpha.,4a.beta.,6.alpha.,8a.alpha.)]-
Alternate Name(s) (2E)-5-[(1S,4aS,6R,8aS)-6-(acetyloxy)-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl]-3-methyl-2-pentenoic acid 3-Acetoxylabda-8(20),13-dien-15-oic acid
CAS Registry Number 63399-37-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-14(13-20(24)25)7-9-17-15(2)8-10-18-21(4,5)19(26-16(3)23)11-12-22(17,18)6/h13,17-19H,2,7-12H2,1,3-6H3,(H,24,25)/b14-13+/t17-,18+,19+,22-/m0/s1
InChIKey OMNJRQNCWHCCBZ-RRFUJITQSA-N
Molecular Weight 362.510 g/mol
SMILES OC(\C=C\(CC[C@@]1([C@]2([C@@](C(C)(C)[C@@](CC2)(OC(=O)C)[H])(CCC1=C)[H])C)[H])C)=O
SPLASH splash10-000i-0953000000-21154b568ba5f202528a
Source of Spectrum F-33-149-0
Wiley ID 1349837