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(Z)-(2-Vinylbenzo[d][1,3]oxazin-4-ylidene)acetic acid methyl ester
SpectraBase Compound ID AAZIn9tuOGq
InChI InChI=1S/C13H11NO3/c1-3-12-14-10-7-5-4-6-9(10)11(17-12)8-13(15)16-2/h3-8H,1H2,2H3/b11-8-
InChIKey YDKUQWAAGQIFRA-FLIBITNWSA-N
Mol Weight 229.23 g/mol
Molecular Formula C13H11NO3
Exact Mass 229.073893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID G2hfMJxebsp
Name (Z)-(2-Vinylbenzo[D][1,3]oxazin-4-ylidene)acetic acid methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.073893215 u
Formula C13H11NO3
InChI InChI=1S/C13H11NO3/c1-3-12-14-10-7-5-4-6-9(10)11(17-12)8-13(15)16-2/h3-8H,1H2,2H3/b11-8-
InChIKey YDKUQWAAGQIFRA-FLIBITNWSA-N
Molecular Weight 229.235 g/mol
SMILES C(\C=C\1OC(=NC=2C1=CC=CC2)C=C)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813663