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(1R,4aS)-7-isopropyl-9-keto-1,4a-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester

Compound with spectra: 1 NMR, and 3 MS (GC)

(1R,4aS)-7-isopropyl-9-keto-1,4a-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester
SpectraBase Compound ID 44FVdXmmuSM
InChI InChI=1S/C21H28O3/c1-13(2)14-7-8-16-15(11-14)17(22)12-18-20(16,3)9-6-10-21(18,4)19(23)24-5/h7-8,11,13,18H,6,9-10,12H2,1-5H3/t18?,20-,21-/m1/s1
InChIKey URPBIQPJABGDJD-VTVVEXCCSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol
Enantiomer InChIKey URPBIQPJABGDJD-LLQWEQGGSA-N

View Spectrum of (1R,4aS)-7-isopropyl-9-keto-1,4a-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum O-35-527-3

View Spectrum of (1R,4aS)-7-isopropyl-9-keto-1,4a-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum Y2-25-1095-2

View Spectrum of (1R,4aS)-7-isopropyl-9-keto-1,4a-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SK-28-3085-2

View Spectrum of (1R,4aS)-7-isopropyl-9-keto-1,4a-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid methyl ester

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • Methyl 7-oxodehydroabietate
(1R,4aS,10aR)-7-isopropyl-1,4a-dimethyl-9-oxo-1,2,3,4,4a,9,10,10a-octahydro-phenanthrene-1-carboxylic acid methyl ester
4-EPIDEHYDROABIETIC ACID
Methyl 7-oxo-6,6-dideuterio-dehydroabietate
7-Oxodehydroabietic acid methyl ester
7-OXO-8,11,13-TRIENE-18-DEHYDROABIETIC ACID METHYL ESTER
Methyl 7-oxo-6,6-dideuterio-dehydroabietate
1,2,3,4,4a,9,10,10a - octahydro - 9 - oxo - 1,4a,7 - trimethyl - phenanthrene - 1 - carboxylic acid, methyl ester
METHYL_13-HYDROXY-7-OXO-8,11,13-PODOCARPATRIEN-19-OATE
15-Hydroxy-7-oxodehydroabietic acid, methyl ester
7-OXO-8,11,13-TRIENE-18-DEHYDROABIETIC ACID
(1R,4aS,10aR)-1,4a-dimethyl-9-oxidanylidene-7-(2-oxidanylpropan-2-yl)-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid
Triptobenzene N
TRIPTOBENZENE-N;19-HYDROXY-3,7-DIOXOABIETA-8,11,13-TRIENE
METHYL-12-HYDROXY-7-OXO-PODOCARPA-8,11,13-TRIEN-19-OATE
Title Journal or Book Year
13C NMR Data for abieta-8,11,13-triene diterpenoids Magnetic Resonance in Chemistry 1994

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7-Oxodehydroabietic acid methyl ester
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