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3H-pyrazol-3-one, 2-(4-aminophenyl)-5-(1-azetidinyl)-2,4-dihydro-
SpectraBase Compound ID 1GNH0Ph3OTB
InChI InChI=1S/C12H14N4O/c13-9-2-4-10(5-3-9)16-12(17)8-11(14-16)15-6-1-7-15/h2-5H,1,6-8,13H2
InChIKey IAXRDFJPSMEFHZ-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C12H14N4O
Exact Mass 230.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AibXBM9MAKF
Name 3H-pyrazol-3-one, 2-(4-aminophenyl)-5-(1-azetidinyl)-2,4-dihydro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N4O
InChI InChI=1S/C12H14N4O/c13-9-2-4-10(5-3-9)16-12(17)8-11(14-16)15-6-1-7-15/h2-5H,1,6-8,13H2
InChIKey IAXRDFJPSMEFHZ-UHFFFAOYSA-N
Molecular Weight 230.271 g/mol
SMILES Nc1ccc(cc1)N1N=C(CC1=O)N1CCC1
SPLASH splash10-001i-9240000000-517fa2314078351f1cdd
Source of Spectrum JX-2015-0-869
Synonyms 1-(4-aminophenyl)-3-(azetidin-1-yl)-1H-pyrazol-5(4H)-one 2-(4-aminophenyl)-5-(azetidin-1-yl)-2,4-dihydro-3H-pyrazol-3-one 2-(4-aminophenyl)-5-(1-azetidinyl)-4H-pyrazol-3-one 2-(4-aminophenyl)-5-(azetidin-1-yl)-4H-pyrazol-3-one
Wiley ID 1720754