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1beta,7-dihydroxy-3beta-acetoxynoreremophil-6(7),9(10)-dien-8-one
SpectraBase Compound ID DFXQ3MBBW3M
InChI InChI=1S/C14H18O5/c1-7-13(19-8(2)15)5-10(16)9-4-11(17)12(18)6-14(7,9)3/h4,6-7,10,13,16,18H,5H2,1-3H3/t7-,10+,13-,14+/m0/s1
InChIKey XVNJVZRMRQNABE-OXSMLMJQSA-N
Mol Weight 266.29 g/mol
Molecular Formula C14H18O5
Exact Mass 266.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4msyXPsmHEp
Name 1beta,7-dihydroxy-3beta-acetoxynoreremophil-6(7),9(10)-dien-8-one
Alternate Name(s) (1R,2S,4R,8aS)-4,7-dihydroxy-1,8a-dimethyl-6-oxo-1,2,3,4,6,8a-hexahydronaphthalen-2-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O5
InChI InChI=1S/C14H18O5/c1-7-13(19-8(2)15)5-10(16)9-4-11(17)12(18)6-14(7,9)3/h4,6-7,10,13,16,18H,5H2,1-3H3/t7-,10+,13-,14+/m0/s1
InChIKey XVNJVZRMRQNABE-OXSMLMJQSA-N
Literature Reference DOI 10.1002/jccs.200400064
Molecular Weight 266.293 g/mol
SMILES O[C@@]1(C[C@@]([C@@]([C@]2(C=C(C(C=C12)=O)O)C)(C)[H])(OC(C)=O)[H])[H]
SPLASH splash10-0006-9000000000-37b6e853f35acefd5ea0
Source of Spectrum QA-51-421-2
Wiley ID 1795924