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5-Butyl-3-(2-hydroxyphenyl)-4-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one
SpectraBase Compound ID JrP6GseHBPU
InChI InChI=1S/C21H21N3O2/c1-2-3-13-24-20(14-9-5-4-6-10-14)17-18(22-23-19(17)21(24)26)15-11-7-8-12-16(15)25/h4-12,20,25H,2-3,13H2,1H3,(H,22,23)
InChIKey FBFBQHZGCORLBG-UHFFFAOYSA-N
Mol Weight 347.42 g/mol
Molecular Formula C21H21N3O2
Exact Mass 347.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQUSRNCM6Tb
Name 5-Butyl-3-(2-hydroxyphenyl)-4-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N3O2
InChI InChI=1S/C21H21N3O2/c1-2-3-13-24-20(14-9-5-4-6-10-14)17-18(22-23-19(17)21(24)26)15-11-7-8-12-16(15)25/h4-12,20,25H,2-3,13H2,1H3,(H,22,23)
InChIKey FBFBQHZGCORLBG-UHFFFAOYSA-N
Molecular Weight 347.418 g/mol
SMILES Oc1c(-c2n[nH]c3c2C(N(C3=O)CCCC)c2ccccc2)cccc1
SPLASH splash10-0f92-1479000000-ae4abc88876fa1c0a2f5
Source of Spectrum IY-2-5171-7
Synonyms Pyrrolo[3,4-c]pyrazol-6(1H)-one, 5-butyl-4,5-dihydro-3-(2-hydroxyphenyl)-4-phenyl-
Wiley ID 1659700