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1,2-dihydro-8-hydroxy-2-oxo-1,4-heptanonaphthalene-6,7-dicarbonic acid-dimethylester
SpectraBase Compound ID 8mKONRy6p47
InChI InChI=1S/C21H24O6/c1-26-20(24)15-11-14-12-8-6-4-3-5-7-9-13(16(22)10-12)17(14)19(23)18(15)21(25)27-2/h10-11,13,23H,3-9H2,1-2H3
InChIKey CDYVKYYVARCMSX-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrlxO8nuWhV
Name 1,2-dihydro-8-hydroxy-2-oxo-1,4-heptanonaphthalene-6,7-dicarbonic acid-dimethylester
CAS Registry Number 102652-26-6
Comments Less than 3 mono-isotopic peaks
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Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-26-20(24)15-11-14-12-8-6-4-3-5-7-9-13(16(22)10-12)17(14)19(23)18(15)21(25)27-2/h10-11,13,23H,3-9H2,1-2H3
InChIKey CDYVKYYVARCMSX-UHFFFAOYSA-N
Molecular Weight 372.417 g/mol
SMILES Oc1c2c(C=3CCCCCCCC2C(C3)=O)cc(c1C(=O)OC)C(=O)OC
SPLASH splash10-0006-0009000000-9e9cddbae627a68e5bbc
Source of Spectrum K-119-2716-12
Synonyms 1,2-Dihydro-8-hydroxy-2-oxo-1,4-heptanonaphthalin-6,7-dicarbonsaure-dimethylester dimethyl 11-hydroxy-17-oxotricyclo[7.6.2.0(10,15)]heptadeca-1(16),10,12,14-tetraene-12,13-dicarboxylate
Wiley ID 1355477