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Phenol, 4-nitro-2-[3-(2-pyridylimino)prop-1-enyl]-
SpectraBase Compound ID GvRctt5yAwO
InChI InChI=1S/C14H11N3O3/c18-13-7-6-12(17(19)20)10-11(13)4-3-9-16-14-5-1-2-8-15-14/h1-10,18H/b4-3+,16-9+
InChIKey OFUYQFCXSRDZTQ-BKXBXYNISA-N
Mol Weight 269.26 g/mol
Molecular Formula C14H11N3O3
Exact Mass 269.080041 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9fPT8LTNe7n
Name Phenol, 4-nitro-2-[3-(2-pyridylimino)prop-1-enyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 269.080041223 u
Formula C14H11N3O3
InChI InChI=1S/C14H11N3O3/c18-13-7-6-12(17(19)20)10-11(13)4-3-9-16-14-5-1-2-8-15-14/h1-10,18H/b4-3+,16-9+
InChIKey OFUYQFCXSRDZTQ-BKXBXYNISA-N
SMILES C1=CC=NC(=C1)\N=C\C=C\C=1C=C(N(=O)=O)C=CC1O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.857065