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Methyl 5-[(4-bromobenzoyl)oxy]-1-phenyl-1H-pyrazole-3-carboxylate
SpectraBase Compound ID 99MTSuS0j4Z
InChI InChI=1S/C18H13BrN2O4/c1-24-18(23)15-11-16(21(20-15)14-5-3-2-4-6-14)25-17(22)12-7-9-13(19)10-8-12/h2-11H,1H3
InChIKey UNOLTTCLTGAGPO-UHFFFAOYSA-N
Mol Weight 401.22 g/mol
Molecular Formula C18H13BrN2O4
Exact Mass 400.00587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3IUY45djM8w
Name Methyl 5-[(4-bromobenzoyl)oxy]-1-phenyl-1H-pyrazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13BrN2O4
InChI InChI=1S/C18H13BrN2O4/c1-24-18(23)15-11-16(21(20-15)14-5-3-2-4-6-14)25-17(22)12-7-9-13(19)10-8-12/h2-11H,1H3
InChIKey UNOLTTCLTGAGPO-UHFFFAOYSA-N
Molecular Weight 401.216 g/mol
SMILES c1([n](nc(c1)C(=O)OC)-c1ccccc1)OC(c1ccc(cc1)Br)=O
SPLASH splash10-0019-2900000000-a32670c94836c2a84f93
Source of Spectrum F-67-4599-7d
Wiley ID 1686689