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(E)-1-(1,3-dimethyl-4-pyrazolyl)-4,4-difluoro-3-(1-hydroxycyclopropyl)-2-buten-1-one
SpectraBase Compound ID 3ZrJuKOkXxV
InChI InChI=1S/C12H14F2N2O2/c1-7-8(6-16(2)15-7)10(17)5-9(11(13)14)12(18)3-4-12/h5-6,11,18H,3-4H2,1-2H3/b9-5-
InChIKey ZLBFCNMZRIRCBI-UITAMQMPSA-N
Mol Weight 256.25 g/mol
Molecular Formula C12H14F2N2O2
Exact Mass 256.102334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COPZlZlIwI1
Name (E)-1-(1,3-dimethyl-4-pyrazolyl)-4,4-difluoro-3-(1-hydroxycyclopropyl)-2-buten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14F2N2O2
InChI InChI=1S/C12H14F2N2O2/c1-7-8(6-16(2)15-7)10(17)5-9(11(13)14)12(18)3-4-12/h5-6,11,18H,3-4H2,1-2H3/b9-5-
InChIKey ZLBFCNMZRIRCBI-UITAMQMPSA-N
Molecular Weight 256.253 g/mol
SMILES OC1(\C(=C/C(c2c(n[n](c2)C)C)=O)C(F)F)CC1
SPLASH splash10-05g3-6900000000-588768fd16a7a8a1d56d
Source of Spectrum K1-2004-3152-26
Synonyms (E)-1-(1,3-dimethylpyrazol-4-yl)-4,4-bis(fluoranyl)-3-(1-oxidanylcyclopropyl)but-2-en-1-one (E)-1-(1,3-dimethylpyrazol-4-yl)-4,4-difluoro-3-(1-hydroxycyclopropyl)but-2-en-1-one
Wiley ID 1561257