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Methyl 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-7-[3'-formylpropanoyl]-1-phenanthrenecarboxylate
SpectraBase Compound ID JLryeURsWGt
InChI InChI=1S/C23H34O4/c1-21(19(25)7-5-14-24)13-10-17-16(15-21)8-9-18-22(17,2)11-6-12-23(18,3)20(26)27-4/h14-15,17-18H,5-13H2,1-4H3
InChIKey HOPUUUVQIJEUNH-UHFFFAOYSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1KknPJLKdH
Name Methyl 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-7-[3'-formylpropanoyl]-1-phenanthrenecarboxylate
CAS Registry Number 142810-91-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-21(19(25)7-5-14-24)13-10-17-16(15-21)8-9-18-22(17,2)11-6-12-23(18,3)20(26)27-4/h14-15,17-18H,5-13H2,1-4H3
InChIKey HOPUUUVQIJEUNH-UHFFFAOYSA-N
Molecular Weight 374.521 g/mol
SMILES C12(C(C(C(=O)OC)(C)CCC2)CCC=2C1CCC(C(=O)CCC=O)(C)C2)C
SPLASH splash10-00g9-0690000000-ab486b6244e97dc1187d
Source of Spectrum U-1992-1022-8
Synonyms Methyl 1,4a,7-trimethyl-7-(4-oxobutanoyl)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-1-carboxylate
Wiley ID 764558