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1-[4-benzoyl-1-(4-methylphenyl)-1H-pyrazol-3-yl]-3-dimethylamino-propenone
SpectraBase Compound ID 49UjFIWWFyO
InChI InChI=1S/C22H21N3O2/c1-16-9-11-18(12-10-16)25-15-19(22(27)17-7-5-4-6-8-17)20(23-25)13-14-21(26)24(2)3/h4-15H,1-3H3/b14-13+
InChIKey QLFIWGNATUCELN-BUHFOSPRSA-N
Mol Weight 359.43 g/mol
Molecular Formula C22H21N3O2
Exact Mass 359.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JafAKSLgRdt
Name 1-[4-benzoyl-1-(4-methylphenyl)-1H-pyrazol-3-yl]-3-dimethylamino-propenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N3O2
InChI InChI=1S/C22H21N3O2/c1-16-9-11-18(12-10-16)25-15-19(22(27)17-7-5-4-6-8-17)20(23-25)13-14-21(26)24(2)3/h4-15H,1-3H3/b14-13+
InChIKey QLFIWGNATUCELN-BUHFOSPRSA-N
Molecular Weight 359.429 g/mol
SMILES c1(c[n](-c2ccc(cc2)C)nc1\C=C\C(N(C)C)=O)C(=O)c1ccccc1
SPLASH splash10-05i1-9112000000-eef169ab74e83bbc559c
Source of Spectrum F2-45-1047-3b
Wiley ID 1689099