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9.alpha.-Cyano-15,16-epoxy-7-hydroxylabda-7,13(16)-14-trien-6-one
SpectraBase Compound ID dCYcFWzVsC
InChI InChI=1S/C21H27NO3/c1-14-16(23)17(24)18-19(2,3)8-5-9-20(18,4)21(14,13-22)10-6-15-7-11-25-12-15/h7,11-12,18,23H,5-6,8-10H2,1-4H3/t18-,20-,21-/m0/s1
InChIKey JYQNEPVNGOJICZ-JBACZVJFSA-N
Mol Weight 341.45 g/mol
Molecular Formula C21H27NO3
Exact Mass 341.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRm1Osimr06
Name 9.alpha.-Cyano-15,16-epoxy-7-hydroxylabda-7,13(16)-14-trien-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO3
InChI InChI=1S/C21H27NO3/c1-14-16(23)17(24)18-19(2,3)8-5-9-20(18,4)21(14,13-22)10-6-15-7-11-25-12-15/h7,11-12,18,23H,5-6,8-10H2,1-4H3/t18-,20-,21-/m0/s1
InChIKey JYQNEPVNGOJICZ-JBACZVJFSA-N
Molecular Weight 341.451 g/mol
SMILES OC=1C(=O)[C@@]2([C@@]([C@](C1C)(C#N)CCc1cocc1)(CCCC2(C)C)C)[H]
SPLASH splash10-004i-3009000000-a9610ed618b4a2d3b0f8
Source of Spectrum KC-61-8497-3
Synonyms (1R,4aS,8aS)-1-[2-(3-furyl)ethyl]-3-hydroxy-2,5,5,8a-tetramethyl-4-oxo-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarbonitrile
Wiley ID 1630309