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PACIFICIN_F
SpectraBase Compound ID 6gfSDG5tCv
InChI InChI=1S/C20H34O2/c1-15-8-6-12-20(5,22)17-14-16(17)19(4,13-9-15)11-7-10-18(2,3)21/h7-8,10,16-17,21-22H,6,9,11-14H2,1-5H3/b10-7+,15-8+/t16-,17-,19-,20-/m0/s1
InChIKey IHSCKGWZAXSIOS-DULQZTKTSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42jQlroFzCR
Name Pacificin F
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-15-8-6-12-20(5,22)17-14-16(17)19(4,13-9-15)11-7-10-18(2,3)21/h7-8,10,16-17,21-22H,6,9,11-14H2,1-5H3/b10-7+,15-8+/t16-,17-,19-,20-/m0/s1
InChIKey IHSCKGWZAXSIOS-DULQZTKTSA-N
Molecular Weight 306.490 g/mol
SMILES O[C@@]1([C@@]2([C@@]([C@@](C\C=C\C(O)(C)C)(CC\C(=C\CC1)C)C)(C2)[H])[H])C
SPLASH splash10-000b-9620000000-f8b4b89c67e7ad81ee80
Source of Spectrum X2-68-77-6
Synonyms (1S,2R,5E,9S,10S)-2-[(E)-4-hydroxy-4-methylpent-2-enyl]-2,5,9-trimethyl-9-bicyclo[8.1.0]undec-5-enol (1S,2R,5E,9S,10S)-2-[(E)-4-hydroxy-4-methylpent-2-enyl]-2,5,9-trimethylbicyclo[8.1.0]undec-5-en-9-ol (1S,2R,5E,9S,10S)-2,5,9-trimethyl-2-[(E)-4-methyl-4-oxidanyl-pent-2-enyl]bicyclo[8.1.0]undec-5-en-9-ol
Wiley ID 1609436