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methyl 3-benzyl-5,5-dimethyl-2,4-dioxo-6-phenyltetrahydro-2H-pyran-3-carboxylate
SpectraBase Compound ID Fd8aGJoXJGp
InChI InChI=1S/C22H22O5/c1-21(2)17(16-12-8-5-9-13-16)27-20(25)22(18(21)23,19(24)26-3)14-15-10-6-4-7-11-15/h4-13,17H,14H2,1-3H3
InChIKey DTLKBEQRYDAEDI-UHFFFAOYSA-N
Mol Weight 366.41 g/mol
Molecular Formula C22H22O5
Exact Mass 366.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rm6tS4kfe
Name 3-Benzyl-5,5-dimethyl-2,4-dioxo-6-phenyl-tetrahydro-pyran-3-carboxylic acid methyl ester
Alternate Name(s) 3-Benzyl-2,4-diketo-5,5-dimethyl-6-phenyl-tetrahydropyran-3-carboxylic acid methyl ester 5,5-Dimethyl-2,4-dioxo-6-phenyl-3-(phenylmethyl)-3-oxanecarboxylic acid methyl ester Methyl 3-benzyl-5,5-dimethyl-2,4-dioxo-6-phenyl-tetrahydropyran-3-carboxylate Methyl 3-benzyl-5,5-dimethyl-2,4-dioxo-6-phenyloxane-3-carboxylate Methyl 3-benzyl-5,5-dimethyl-2,4-dioxo-6-phenyltetrahydro-2H-pyran-3-carboxylate Methyl 5,5-dimethyl-2,4-bis(oxidanylidene)-6-phenyl-3-(phenylmethyl)oxane-3-carboxylate
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Formula C22H22O5
InChI InChI=1S/C22H22O5/c1-21(2)17(16-12-8-5-9-13-16)27-20(25)22(18(21)23,19(24)26-3)14-15-10-6-4-7-11-15/h4-13,17H,14H2,1-3H3
InChIKey DTLKBEQRYDAEDI-UHFFFAOYSA-N
Molecular Weight 366.413 g/mol
SMILES C1(C(C(C)(C)C(OC1=O)c1ccccc1)=O)(C(=O)OC)Cc1ccccc1
SPLASH splash10-008c-4910000000-aa671d232924f4932230
Wiley ID 1464589