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(14R)-Isoagath-12-ene-15,16-diol

View entire compound with spectra: 2 MS (GC)

(14R)-Isoagath-12-ene-15,16-diol
SpectraBase Compound ID HdupYneTgwC
InChI InChI=1S/C20H34O2/c1-18(2)9-5-10-20(4)16(18)8-11-19(3)15(13-22)14(12-21)6-7-17(19)20/h6,15-17,21-22H,5,7-13H2,1-4H3/t15?,16?,17?,19-,20-/m0/s1
InChIKey BYRWIOZWTAEHKN-GTSVPISWSA-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 3QVRY3fbyDl
Name (14R)-Isoagath-12-ene-15,16-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-18(2)9-5-10-20(4)16(18)8-11-19(3)15(13-22)14(12-21)6-7-17(19)20/h6,15-17,21-22H,5,7-13H2,1-4H3/t15?,16?,17?,19-,20-/m0/s1
InChIKey BYRWIOZWTAEHKN-GTSVPISWSA-N
Molecular Weight 306.490 g/mol
SMILES OCC1C(CO)=CCC2[C@]1(CCC1C(CCC[C@]21C)(C)C)C
SPLASH splash10-0006-0900000000-0a78771b17d145782db6
Source of Spectrum X4-20-689-0
Synonyms (14S)-Isoagath-12-ene-15,16-diol
Wiley ID 1585750