3-Amino-1-phenyl-2-pyrazolin-5-one

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Systematic / IUPAC Name: 5-Amino-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

ID: Reference2601

Other Names: 2,4-Dihydro-5-amino-2-phenyl-3H-pyrazol-3-one;
3H-Pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl-;
3H-Pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl-;
3-Amino-1-phenyl-1H-pyrazol-5(4H)-one;
3-Amino-1-phenyl-4,5-dihydro-1H-pyrazol-5-one

Formula: C9H9N3O

Spectral Data

3-Amino-1-phenyl-2-pyrazolin-5-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/20/2015 7:17:22 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C9H9N3O/c10-8-6-9(13)12(11-8)7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,11)
InChI Key LPOVZHYARSAVIZ-UHFFFAOYSA-N
Canonical SMILES C1C(=NN(C1=O)C2=CC=CC=C2)N
CAS 4149068
Splash
Other Names 2,4-Dihydro-5-amino-2-phenyl-3H-pyrazol-3-one;
3H-Pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl-;
3H-Pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl-;
3-Amino-1-phenyl-1H-pyrazol-5(4H)-one;
3-Amino-1-phenyl-4,5-dihydro-1H-pyrazol-5-one;
3-Amino-4,5-dihydro-1-phenyl-1H-pyrazol-5-one

In Other Databases

ChemSpider 70191
ChemIDPlus 004149068
PubChem 77794
ChEMBL CHEMBL1872892