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(2-chlorophenyl)methyl 4-(4-bromo-1H-pyrazol-1-yl)benzoate
SpectraBase Compound ID 9a5UT3gYHPD
InChI InChI=1S/C17H12BrClN2O2/c18-14-9-20-21(10-14)15-7-5-12(6-8-15)17(22)23-11-13-3-1-2-4-16(13)19/h1-10H,11H2
InChIKey RBWROPPVAWACBU-UHFFFAOYSA-N
Mol Weight 391.65 g/mol
Molecular Formula C17H12BrClN2O2
Exact Mass 389.977068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzxqKpab9rf
Name (2-chlorophenyl)methyl 4-(4-bromo-1H-pyrazol-1-yl)benzoate
Alternate Name(s) Benzoic acid, 4-(4-bromo-1H-pyrazol-1-yl)-, (2-chlorophenyl)methyl ester 4-(4-bromo-1-pyrazolyl)benzoic acid (2-chlorophenyl)methyl ester (2-chlorophenyl)methyl 4-(4-bromopyrazol-1-yl)benzoate (2-chlorophenyl)methyl 4-(4-bromanylpyrazol-1-yl)benzoate
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Formula C17H12BrClN2O2
InChI InChI=1S/C17H12BrClN2O2/c18-14-9-20-21(10-14)15-7-5-12(6-8-15)17(22)23-11-13-3-1-2-4-16(13)19/h1-10H,11H2
InChIKey RBWROPPVAWACBU-UHFFFAOYSA-N
Molecular Weight 391.652 g/mol
SMILES c1(ccccc1COC(c1ccc(-[n]2ncc(Br)c2)cc1)=O)Cl
SPLASH splash10-004i-3962000000-e606168f3a3f0b266b42
Source of Spectrum IY-2-5190-6
Wiley ID 1659889