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3-(Benzo[d][1,3]dioxol-5-yl)-5-(4-(trifluoromethyl)phenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
SpectraBase Compound ID Dy6FAbjh9a6
InChI InChI=1S/C18H13F3N2O3/c19-18(20,21)13-4-1-11(2-5-13)15-8-14(22-23(15)9-24)12-3-6-16-17(7-12)26-10-25-16/h1-7,9,15H,8,10H2
InChIKey LWKSNPNVSVFBIF-UHFFFAOYSA-N
Mol Weight 362.31 g/mol
Molecular Formula C18H13F3N2O3
Exact Mass 362.087827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oSVlwBb8d5
Name 3-(Benzo[d][1,3]dioxol-5-yl)-5-(4-(trifluoromethyl)phenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3N2O3
InChI InChI=1S/C18H13F3N2O3/c19-18(20,21)13-4-1-11(2-5-13)15-8-14(22-23(15)9-24)12-3-6-16-17(7-12)26-10-25-16/h1-7,9,15H,8,10H2
InChIKey LWKSNPNVSVFBIF-UHFFFAOYSA-N
Molecular Weight 362.308 g/mol
SMILES c1c(C2=NN(C(C2)c2ccc(cc2)C(F)(F)F)C=O)cc2OCOc2c1
SPLASH splash10-01q9-0009000000-605113c75a500b11229f
Source of Spectrum APC-345-281-5e
Wiley ID 1769338