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1-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,4B,5,6,10,10A-DECAHYDRO-1,4A-DIMETHYL-
SpectraBase Compound ID LObz91CuFKP
InChI InChI=1S/C21H32O2/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/h8,13-14,17-18H,6-7,9-12H2,1-5H3
InChIKey OVXRPXGVKBHGQO-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHHFrGlNQ7Y
Name 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,10a.alpha.)]-
CAS Registry Number 127-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/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/h8,13-14,17-18H,6-7,9-12H2,1-5H3
InChIKey OVXRPXGVKBHGQO-UHFFFAOYSA-N
Molecular Weight 316.485 g/mol
SMILES CC12C(C(C(OC)=O)(C)CCC2)CC=C2C1CCC(=C2)C(C)C
SPLASH splash10-0aor-3695000000-ba5d738009e6b69a5e3a
Source of Spectrum O-35-525-1
Synonyms Methyl abieta-7,13-dien-18-oate 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, (1R,4aR,4bR,10aR)- 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester Podocarpa-7,13-dien-15-oic acid, 13-isopropyl-, methyl ester Abalyn Methyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate Methyl 7,13-abietadien-18-oate Methyl 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate Methyl abietate Methyl abietate isomer Methyl abietate, technical Methyl ester of wood rosin Methyl resinate Methyl rosinate Wood rosin, methyl ester AI3-01745 BRN 2702228 EINECS 204-832-7 NSC 2141
Wiley ID 763603