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1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]-

View entire compound with spectra: 4 MS (GC)

1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]-
SpectraBase Compound ID 20sfnjtqJN
InChI InChI=1S/C21H34O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h13-15,17-18H,6-12H2,1-5H3
InChIKey QKIYXILRDUTSOO-UHFFFAOYSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sl891oiN3V
Name 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]-
CAS Registry Number 33892-17-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h13-15,17-18H,6-12H2,1-5H3
InChIKey QKIYXILRDUTSOO-UHFFFAOYSA-N
Molecular Weight 318.501 g/mol
SMILES C12C(CCCC2(C2CCC(C=C2CC1)C(C)C)C)(C)C(OC)=O
SPLASH splash10-01e9-4941000000-b5543661f00835b44ed2
Source of Spectrum AD-0-5301-0
Synonyms 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.alpha.,10a.alpha.)]- Methyl abiet-8(14)-en-18-oate 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylic acid methyl ester 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylic acid methyl ester Methyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate Methyl 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate Methyl 8(14)-abieten-18-oate Podocarp-8(14)-en-15-oic acid, 13.alpha.-isopropyl-, methyl ester Podocarp-8(14)-en-15-oic acid, 13.beta.-isopropyl-, methyl ester
Wiley ID 47551