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Methyl x,x,x - abietatrienoate
SpectraBase Compound ID Ehq6LahvYwe
InChI InChI=1S/C21H30O2/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/h7,9,13-14,18H,6,8,10-12H2,1-5H3
InChIKey PGZCJOPTDHWYES-UHFFFAOYSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AsiaVMMKhj
Name PHENANTHREN-1-CARBOXYLIC ACID, 1,2,3,4,4A,9,10,10A-OCTAHYDRO-7-ISOPROPYL-1,4A-DIMETHYL-, METHYL ESTER (DEHYDROABIETIC ACID, METHYL ESTER)
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Formula C21H30O2
InChI InChI=1S/C21H30O2/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/h7,9,13-14,18H,6,8,10-12H2,1-5H3
InChIKey PGZCJOPTDHWYES-UHFFFAOYSA-N
Instrument Name CH7
Molecular Weight 314.2238
SMILES C1CC2(c3ccc(C(C)C)cc3CCC2C(C(OC)=O)(C)C1)C
SPLASH splash10-000l-5960000000-8a5268afb17b2d2be1bd
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany