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Methyl 8.alpha.-Hydroxy-3-oxo-11.beta.H-eudesma-1,4,6-trien-12-oate
SpectraBase Compound ID Epx2nJhxopx
InChI InChI=1S/C16H20O4/c1-9(15(19)20-4)11-7-12-10(2)13(17)5-6-16(12,3)8-14(11)18/h5-7,9,14,18H,8H2,1-4H3/t9-,14+,16-/m1/s1
InChIKey OOWLUGNLHXYCSE-WKFLNTIRSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ea03hpyvfF9
Name Methyl 8.alpha.-Hydroxy-3-oxo-11.beta.H-eudesma-1,4,6-trien-12-oate
CAS Registry Number 135557-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-9(15(19)20-4)11-7-12-10(2)13(17)5-6-16(12,3)8-14(11)18/h5-7,9,14,18H,8H2,1-4H3/t9-,14+,16-/m1/s1
InChIKey OOWLUGNLHXYCSE-WKFLNTIRSA-N
Molecular Weight 276.332 g/mol
SMILES O[C@]1(C[C@@]2(C(C=C1[C@](C(=O)OC)(C)[H])=C(C(C=C2)=O)C)C)[H]
SPLASH splash10-0079-0960000000-c987e7f4e7229c2f4e33
Source of Spectrum J-56-6174-4
Synonyms Methyl (2R)-2-[(3S,4aS)-3-hydroxy-4a,8-dimethyl-7-oxo-3,4,4a,7-tetrahydro-2-naphthalenyl]propanoate
Wiley ID 1280200