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Benzyl 5-(4-fluorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
SpectraBase Compound ID 2e0TZbknNN5
InChI InChI=1S/C19H14FN3O4/c20-12-6-8-13(9-7-12)23-17(24)14-15(18(23)25)21-22-16(14)19(26)27-10-11-4-2-1-3-5-11/h1-9,14-15,21H,10H2
InChIKey KBHHTOSFOTZBJL-UHFFFAOYSA-N
Mol Weight 367.34 g/mol
Molecular Formula C19H14FN3O4
Exact Mass 367.096834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0gemP5sN1a
Name Benzyl 5-(4-fluorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14FN3O4
InChI InChI=1S/C19H14FN3O4/c20-12-6-8-13(9-7-12)23-17(24)14-15(18(23)25)21-22-16(14)19(26)27-10-11-4-2-1-3-5-11/h1-9,14-15,21H,10H2
InChIKey KBHHTOSFOTZBJL-UHFFFAOYSA-N
Molecular Weight 367.336 g/mol
SMILES N1N=C(C2C1C(N(C2=O)c1ccc(cc1)F)=O)C(OCc1ccccc1)=O
SPLASH splash10-0006-9400000000-c74ada87e4e150c2d648
Synonyms (phenylmethyl) 5-(4-fluorophenyl)-4,6-bis(oxidanylidene)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate 5-(4-fluorophenyl)-4,6-diketo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid benzyl ester 5-(4-fluorophenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid (phenylmethyl) ester benzyl 5-(4-fluorophenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate Pyrrolo[3,4-c]pyrazole-3-carboxylic acid, 5-(4-fluorophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydro-, benzyl ester
Wiley ID 1447664