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6-(6-keto-3,4-diphenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl)hexanoic acid
SpectraBase Compound ID HQ88KShBsNh
InChI InChI=1S/C23H23N3O3/c27-18(28)14-8-3-9-15-26-22(17-12-6-2-7-13-17)19-20(16-10-4-1-5-11-16)24-25-21(19)23(26)29/h1-2,4-7,10-13,22H,3,8-9,14-15H2,(H,24,25)(H,27,28)
InChIKey LZOKZSZIFJHWRJ-UHFFFAOYSA-N
Mol Weight 389.46 g/mol
Molecular Formula C23H23N3O3
Exact Mass 389.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DcETaY1KU74
Name 6-(6-keto-3,4-diphenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl)hexanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N3O3
InChI InChI=1S/C23H23N3O3/c27-18(28)14-8-3-9-15-26-22(17-12-6-2-7-13-17)19-20(16-10-4-1-5-11-16)24-25-21(19)23(26)29/h1-2,4-7,10-13,22H,3,8-9,14-15H2,(H,24,25)(H,27,28)
InChIKey LZOKZSZIFJHWRJ-UHFFFAOYSA-N
Molecular Weight 389.455 g/mol
SMILES OC(CCCCCN1C(c2c(C1=O)[nH]nc2-c1ccccc1)c1ccccc1)=O
SPLASH splash10-0k9l-9771000000-47a062e30edd058cc738
Synonyms 6-(6-oxidanylidene-3,4-diphenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl)hexanoic acid 6-(6-oxo-3,4-diphenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl)hexanoic acid
Wiley ID 1452369