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Methyl dehydroabietyl succinate

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Methyl dehydroabietyl succinate
SpectraBase Compound ID KJGoLhxL3uM
InChI InChI=1S/C25H36O4/c1-17(2)18-7-9-20-19(15-18)8-10-21-24(3,13-6-14-25(20,21)4)16-29-23(27)12-11-22(26)28-5/h7,9,15,17,21H,6,8,10-14,16H2,1-5H3/t21-,24+,25+/m0/s1
InChIKey GBNDVFBBFXZTRE-FTBPSBKWSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGpmS3zYr9G
Name Methyl dehydroabietyl succinate
CAS Registry Number 95863-58-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-17(2)18-7-9-20-19(15-18)8-10-21-24(3,13-6-14-25(20,21)4)16-29-23(27)12-11-22(26)28-5/h7,9,15,17,21H,6,8,10-14,16H2,1-5H3/t21-,24+,25+/m0/s1
InChIKey GBNDVFBBFXZTRE-FTBPSBKWSA-N
Molecular Weight 400.559 g/mol
SMILES [C@]12(c3c(cc(cc3)C(C)C)CC[C@]1([C@](COC(=O)CCC(=O)OC)(C)CCC2)[H])C
SPLASH splash10-0uxr-3390000000-2cd3fefbdb4b7c7ca88a
Source of Spectrum Va-0-0-0
Synonyms 1-[(4alpha)-abieta-8,11,13-trien-18-yl]4-methyl succinate [1R-(1.alpha.,4a.beta.,10a.alpha.)]- butanedioic acid, methyl[1,2,3,4,4a9,10,10a-octahydro-1.4a-dimethyl-7 -(1-methylethyl)-1-phenanthrenyl]methyl ester
Wiley ID 739631
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