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Methyl 4-acetyl-2-(benzoylamino)-5-methylbenzoate

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Methyl 4-acetyl-2-(benzoylamino)-5-methylbenzoate
SpectraBase Compound ID ILKptlcg53o
InChI InChI=1S/C18H17NO4/c1-11-9-15(18(22)23-3)16(10-14(11)12(2)20)19-17(21)13-7-5-4-6-8-13/h4-10H,1-3H3,(H,19,21)
InChIKey PSQWHFCWRWHWCM-UHFFFAOYSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9H6UPYWQuZj
Name Methyl 4-acetyl-2-(benzoylamino)-5-methylbenzoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.115758027 u
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c1-11-9-15(18(22)23-3)16(10-14(11)12(2)20)19-17(21)13-7-5-4-6-8-13/h4-10H,1-3H3,(H,19,21)
InChIKey PSQWHFCWRWHWCM-UHFFFAOYSA-N
Molecular Weight 311.337 g/mol
SMILES C(C=1C(=CC(=C(C1)C)C(=O)C)NC(C=1C=CC=CC1)=O)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941485