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Methyl 12-Oxo-13,14,15,16-tetranor-ent-halima-1(10)-en-18-oate
SpectraBase Compound ID 94rRT9LJq3w
InChI InChI=1S/C17H26O3/c1-12-7-8-14-13(16(12,2)10-11-18)6-5-9-17(14,3)15(19)20-4/h6,11-12,14H,5,7-10H2,1-4H3/t12-,14+,16+,17+/m1/s1
InChIKey WCTUFKTZOGXOBM-QCPWZWHMSA-N
Mol Weight 278.39 g/mol
Molecular Formula C17H26O3
Exact Mass 278.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tanLbiim0f
Name Methyl 12-Oxo-13,14,15,16-tetranor-ent-halima-1(10)-en-18-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3
InChI InChI=1S/C17H26O3/c1-12-7-8-14-13(16(12,2)10-11-18)6-5-9-17(14,3)15(19)20-4/h6,11-12,14H,5,7-10H2,1-4H3/t12-,14+,16+,17+/m1/s1
InChIKey WCTUFKTZOGXOBM-QCPWZWHMSA-N
Molecular Weight 278.392 g/mol
SMILES C1=2[C@@]([C@](C(=O)OC)(C)CCC2)(CC[C@]([C@@]1(CC=O)C)(C)[H])[H]
SPLASH splash10-0059-0980000000-803267403b09fdfa8870
Source of Spectrum F4-0-3869-5
Synonyms (1S,5S,6R,8aS)-1,5,6-trimethyl-5-(2-oxoethyl)-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylic acid methyl ester Methyl (1S,5S,6R,8aS)-1,5,6-trimethyl-5-(2-oxoethyl)-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylate Methyl (1S,5S,6R,8aS)-1,5,6-trimethyl-5-(2-oxidanylideneethyl)-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylate
Wiley ID 1621039