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3-Phenyl-9,10,11,12-tetrahydro-8H-cyclodeca[c]pyran-5,6-dicarboxylic acid dimethyl ester
SpectraBase Compound ID IlNmK3sTfN2
InChI InChI=1S/C23H24O5/c1-26-22(24)18-13-9-4-3-6-12-17-15-28-20(16-10-7-5-8-11-16)14-19(17)21(18)23(25)27-2/h5,7-8,10-11,13-15H,3-4,6,9,12H2,1-2H3/b18-13+,21-19+
InChIKey STXKOTVGFXQOKU-LCIBDEIJSA-N
Mol Weight 380.44 g/mol
Molecular Formula C23H24O5
Exact Mass 380.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J87zogfjxLF
Name 3-Phenyl-9,10,11,12-tetrahydro-8H-cyclodeca[c]pyran-5,6-dicarboxylic acid dimethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C23H24O5
InChI InChI=1S/C23H24O5/c1-26-22(24)18-13-9-4-3-6-12-17-15-28-20(16-10-7-5-8-11-16)14-19(17)21(18)23(25)27-2/h5,7-8,10-11,13-15H,3-4,6,9,12H2,1-2H3/b18-13+,21-19+
InChIKey STXKOTVGFXQOKU-LCIBDEIJSA-N
Molecular Weight 380.440 g/mol
SMILES C1=C2\C(C=C(O1)c1ccccc1)=C/(\C(=C/CCCCC2)C(=O)OC)C(=O)OC
SPLASH splash10-00di-0009000000-1ffa511bf8d5d7b5d7a1
Source of Spectrum CV-2004-1411-3
Synonyms dimethyl 3-phenyl-9,10,11,12-tetrahydro-8H-cyclodeca[c]pyran-5,6-dicarboxylate
Wiley ID 1611489