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2-(4-nitrophenyl)-N-methylaniline
SpectraBase Compound ID HCJlKZs1xkI
InChI InChI=1S/C13H12N2O2/c1-14-13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16)17/h2-9,14H,1H3
InChIKey HCHHVRAEVJRVFW-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EFuA2i4NjPp
Name 2-(4-Nitrophenyl)-N-methylaniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.089877632 u
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c1-14-13-5-3-2-4-12(13)10-6-8-11(9-7-10)15(16)17/h2-9,14H,1H3
InChIKey HCHHVRAEVJRVFW-UHFFFAOYSA-N
Molecular Weight 228.251 g/mol
SMILES C=1(NC)C(=CC=CC1)C=1C=CC(=CC1)[N+](=O)[O-]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973262