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(1R,4aS)-6-methoxy-1,4a-dimethyl-2-oxo-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene-1-carboxylic acid ethyl ester
SpectraBase Compound ID H38DAfKM735
InChI InChI=1S/C23H32O4/c1-7-27-21(25)23(5)19-9-8-15-12-16(14(2)3)18(26-6)13-17(15)22(19,4)11-10-20(23)24/h12-14,19H,7-11H2,1-6H3/t19?,22-,23-/m1/s1
InChIKey HQBRROJAHIVJIN-QENMJEOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C23H32O4
Exact Mass 372.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHyRudNivna
Name (1R,4aS)-6-methoxy-1,4a-dimethyl-2-oxo-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene-1-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O4
InChI InChI=1S/C23H32O4/c1-7-27-21(25)23(5)19-9-8-15-12-16(14(2)3)18(26-6)13-17(15)22(19,4)11-10-20(23)24/h12-14,19H,7-11H2,1-6H3/t19?,22-,23-/m1/s1
InChIKey HQBRROJAHIVJIN-QENMJEOYSA-N
Molecular Weight 372.505 g/mol
SMILES [C@@]1(C2[C@](c3cc(OC)c(cc3CC2)C(C)C)(C)CCC1=O)(C(=O)OCC)C
SPLASH splash10-05fr-0049000000-b6a9aa99c04dfa511d96
Source of Spectrum X2-56-469-25
Synonyms (1R,4aS)-7-isopropyl-2-keto-6-methoxy-1,4a-dimethyl-4,9,10,10a-tetrahydro-3H-phenanthrene-1-carboxylic acid ethyl ester Ethyl (1R,4aS)-6-methoxy-1,4a-dimethyl-2-oxidanylidene-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene-1-carboxylate Ethyl (1R,4aS)-6-methoxy-1,4a-dimethyl-2-oxo-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene-1-carboxylate Ethyl (1R,4aS)-7-isopropyl-6-methoxy-1,4a-dimethyl-2-oxo-4,9,10,10a-tetrahydro-3H-phenanthrene-1-carboxylate
Wiley ID 1604781