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3.beta.-Hydroxy-3.alpha.-methyl-19-nor-abieta-8,11,13-triene
SpectraBase Compound ID 6pN5m1S6ibc
InChI InChI=1S/C20H30O/c1-13(2)15-6-9-18-16(12-15)7-8-17-14(3)20(5,21)11-10-19(17,18)4/h6,9,12-14,17,21H,7-8,10-11H2,1-5H3/t14-,17-,19-,20-/m0/s1
InChIKey IOEZUZPRRKDLJY-HSCHXYMDSA-N
Mol Weight 286.46 g/mol
Molecular Formula C20H30O
Exact Mass 286.229666 g/mol
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Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BqVVt1DoCVt
Name 3.beta.-Hydroxy-3.alpha.-methyl-19-nor-abieta-8,11,13-triene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.229665585 u
Formula C20H30O
InChI InChI=1S/C20H30O/c1-13(2)15-6-9-18-16(12-15)7-8-17-14(3)20(5,21)11-10-19(17,18)4/h6,9,12-14,17,21H,7-8,10-11H2,1-5H3/t14-,17-,19-,20-/m0/s1
InChIKey IOEZUZPRRKDLJY-HSCHXYMDSA-N
SMILES [C@@]12([C@]([C@@](C)([H])[C@](CC2)(O)C)(CCC2=C1C=CC(C(C)C)=C2)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899877
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