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2-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-7-hydroxy-2,4b,8,8-tetramethyl-, methyl ester
SpectraBase Compound ID 70wd5rrN255
InChI InChI=1S/C20H32O3/c1-18(2)15-7-6-13-12-19(3,17(22)23-5)10-8-14(13)20(15,4)11-9-16(18)21/h6,14-16,21H,7-12H2,1-5H3
InChIKey LTCVLBZDXLJXBS-UHFFFAOYSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Uu5wuYY8AE
Name 2-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-7-hydroxy-2,4b,8,8-tetramethyl-, methyl ester
CAS Registry Number 57397-06-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-18(2)15-7-6-13-12-19(3,17(22)23-5)10-8-14(13)20(15,4)11-9-16(18)21/h6,14-16,21H,7-12H2,1-5H3
InChIKey LTCVLBZDXLJXBS-UHFFFAOYSA-N
Molecular Weight 320.473 g/mol
SMILES OC1C(C2C(C)(C3C(CC(CC3)(C(OC)=O)C)=CC2)CC1)(C)C
SPLASH splash10-05i9-3951000000-ae4f4324db9afbec73c7
Source of Spectrum EP-7970-0-0
Synonyms Methyl 3-hydroxy-13-methylpodocarp-7-ene-13-carboxylate 7-Hydroxy-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene-2-carboxylic acid methyl ester Methyl 2,4b,8,8-tetramethyl-7-oxidanyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene-2-carboxylate Methyl 7-hydroxy-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene-2-carboxylate
Wiley ID 1320391