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Methyl 4-((2-formyl-5-(trifluoromethyl)phenyl)carbamoyl)benzoate
SpectraBase Compound ID CvutqRG3UVU
InChI InChI=1S/C17H12F3NO4/c1-25-16(24)11-4-2-10(3-5-11)15(23)21-14-8-13(17(18,19)20)7-6-12(14)9-22/h2-9H,1H3,(H,21,23)
InChIKey ZKUGICDPRGLCMR-UHFFFAOYSA-N
Mol Weight 351.28 g/mol
Molecular Formula C17H12F3NO4
Exact Mass 351.071842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56C790937GU
Name Methyl 4-((2-formyl-5-(trifluoromethyl)phenyl)carbamoyl)benzoate
Appearance Yellow solid
Carrier Gas Argon
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Exact Mass 351.071842355 u
Formula C17H12F3NO4
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C17H12F3NO4/c1-25-16(24)11-4-2-10(3-5-11)15(23)21-14-8-13(17(18,19)20)7-6-12(14)9-22/h2-9H,1H3,(H,21,23)
InChIKey ZKUGICDPRGLCMR-UHFFFAOYSA-N
Instrument Name Agilent HP-5890
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703994
Molecular Weight 351.281 g/mol
Quality 170
Reported Formula C17H12F3NO4
SMILES N(C(C1=CC=C(C(OC)=O)C=C1)=O)C1=C(C=CC(=C1)C(F)(F)F)C=O
SPLASH splash10-03di-0901000000-2a603e5ad78c8b5a8cdd
Source of Spectrum QE-23-SM14-4g (DOI: 10.1002/chem.201703994)
Wiley ID 1905975