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1,2-Dimethyl 3-[(methoxycarbonyl)amino]phthalate

View entire compound with spectra: 1 FTIR

1,2-Dimethyl 3-[(methoxycarbonyl)amino]phthalate
SpectraBase Compound ID JEZc62DcsSC
InChI InChI=1S/C12H13NO6/c1-17-10(14)7-5-4-6-8(13-12(16)19-3)9(7)11(15)18-2/h4-6H,1-3H3,(H,13,16)
InChIKey ROSNQJOSWQDYFZ-UHFFFAOYSA-N
Mol Weight 267.24 g/mol
Molecular Formula C12H13NO6
Exact Mass 267.074287 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CIdUlcztabi
Name 1,2-Dimethyl 3-[(methoxycarbonyl)amino]phthalate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.074287137 u
Formula C12H13NO6
InChI InChI=1S/C12H13NO6/c1-17-10(14)7-5-4-6-8(13-12(16)19-3)9(7)11(15)18-2/h4-6H,1-3H3,(H,13,16)
InChIKey ROSNQJOSWQDYFZ-UHFFFAOYSA-N
Molecular Weight 267.237 g/mol
SMILES C1=C(C(=C(C=C1)C(OC)=O)C(OC)=O)NC(OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96082