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(E)-5-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-3-methyl-2-pentenoic acid

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

(E)-5-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-3-methyl-2-pentenoic acid
SpectraBase Compound ID Ia830BF0PkK
InChI InChI=1S/C20H30O2/c1-13(11-18(21)22)5-7-16-14(2)6-8-17-19(16,3)10-9-15-12-20(15,17)4/h11,15-17H,2,5-10,12H2,1,3-4H3,(H,21,22)/b13-11+/t15-,16-,17+,19+,20+/m1/s1
InChIKey PCLDEDSUWNZZDJ-DTNIWGDASA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ShHpVQMPQ
Name (E)-5-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-3-methyl-2-pentenoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-13(11-18(21)22)5-7-16-14(2)6-8-17-19(16,3)10-9-15-12-20(15,17)4/h11,15-17H,2,5-10,12H2,1,3-4H3,(H,21,22)/b13-11+/t15-,16-,17+,19+,20+/m1/s1
InChIKey PCLDEDSUWNZZDJ-DTNIWGDASA-N
Molecular Weight 302.458 g/mol
SMILES OC(\C=C\(CC[C@]1([C@]2([C@@]([C@]3(C[C@]3(CC2)[H])C)(CCC1=C)[H])C)[H])C)=O
SPLASH splash10-0019-3960000000-8aa6955cc9e746c7c9ff
Source of Spectrum KC-0-1842-2
Synonyms (E)-5-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-3-methyl-pent-2-enoic acid (E)-5-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-3-methyl-pent-2-enoic acid
Wiley ID 822625