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5-Azulenepropanol, decahydro-6-(hydroxymethyl)-3a,6-dimethyl-.gamma.-methylene-1-(1-methylethenyl)-, (1.alpha.,3a.beta.,5.alpha.,6.beta.,8a.alpha.)-

View entire compound with spectra: 1 MS (GC)

5-Azulenepropanol, decahydro-6-(hydroxymethyl)-3a,6-dimethyl-.gamma.-methylene-1-(1-methylethenyl)-, (1.alpha.,3a.beta.,5.alpha.,6.beta.,8a.alpha.)-
SpectraBase Compound ID 7lB1IGHAhKI
InChI InChI=1S/C20H34O2/c1-14(2)16-6-9-19(4)12-18(15(3)8-11-21)20(5,13-22)10-7-17(16)19/h16-18,21-22H,1,3,6-13H2,2,4-5H3/t16-,17-,18+,19+,20-/m0/s1
InChIKey NXTUYGIVHTZFFS-OMZCGLGVSA-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 8U8zwehu1iD
Name 5-Azulenepropanol, decahydro-6-(hydroxymethyl)-3a,6-dimethyl-.gamma.-methylene-1-(1-methylethenyl)-, (1.alpha.,3a.beta.,5.alpha.,6.beta.,8a.alpha.)-
Alternate Name(s) 3,4-Dihydroxy-3,4-secoclavulara-1(15),17-diene 3-[(1R,3aR,5R,6R,8aS)-6-(hydroxymethyl)-1-isopropenyl-3a,6-dimethyldecahydro-5-azulenyl]-3-buten-1-ol
CAS Registry Number 69301-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-14(2)16-6-9-19(4)12-18(15(3)8-11-21)20(5,13-22)10-7-17(16)19/h16-18,21-22H,1,3,6-13H2,2,4-5H3/t16-,17-,18+,19+,20-/m0/s1
InChIKey NXTUYGIVHTZFFS-OMZCGLGVSA-N
Molecular Weight 306.490 g/mol
SMILES OCCC([C@@]1([C@](CO)(CC[C@@]2([C@@](C1)(CC[C@]2(C(=C)C)[H])C)[H])C)[H])=C
SPLASH splash10-0006-9030000000-cb6534610d35d1cf5344
Source of Spectrum F-34-1556-0
Wiley ID 1308530