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Benzyl 5-(4-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
SpectraBase Compound ID 1qwgTsQFN1f
InChI InChI=1S/C20H17N3O5/c1-27-14-9-7-13(8-10-14)23-18(24)15-16(19(23)25)21-22-17(15)20(26)28-11-12-5-3-2-4-6-12/h2-10,15-16,21H,11H2,1H3
InChIKey BZILHKWBVUWUJV-UHFFFAOYSA-N
Mol Weight 379.37 g/mol
Molecular Formula C20H17N3O5
Exact Mass 379.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FI5yS3qi9yy
Name Benzyl 5-(4-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Alternate Name(s) (phenylmethyl) 5-(4-methoxyphenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate 4,6-Diketo-5-(4-methoxyphenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid benzyl ester 5-(4-Methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid (phenylmethyl) ester benzyl 5-(4-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate Pyrrolo[3,4-c]pyrazole-3-carboxylic acid, 5-(4-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydro-, benzyl ester
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Formula C20H17N3O5
InChI InChI=1S/C20H17N3O5/c1-27-14-9-7-13(8-10-14)23-18(24)15-16(19(23)25)21-22-17(15)20(26)28-11-12-5-3-2-4-6-12/h2-10,15-16,21H,11H2,1H3
InChIKey BZILHKWBVUWUJV-UHFFFAOYSA-N
Molecular Weight 379.372 g/mol
SMILES N1N=C(C2C1C(N(C2=O)c1ccc(cc1)OC)=O)C(OCc1ccccc1)=O
SPLASH splash10-0006-9301000000-411412c8b5f4ddb4457f
Wiley ID 1446909