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(4-Nitrophenyl)(m-tolyl)methanol

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

(4-Nitrophenyl)(m-tolyl)methanol
SpectraBase Compound ID 2ypgw3mkExe
InChI InChI=1S/C14H13NO3/c1-10-3-2-4-12(9-10)14(16)11-5-7-13(8-6-11)15(17)18/h2-9,14,16H,1H3
InChIKey WKQLCTBNDCYSAY-UHFFFAOYSA-N
Mol Weight 243.26 g/mol
Molecular Formula C14H13NO3
Exact Mass 243.089543 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2CdJphRIuuL
Name (4-Nitrophenyl)(m-tolyl)methanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.089543280 u
Formula C14H13NO3
InChI InChI=1S/C14H13NO3/c1-10-3-2-4-12(9-10)14(16)11-5-7-13(8-6-11)15(17)18/h2-9,14,16H,1H3
InChIKey WKQLCTBNDCYSAY-UHFFFAOYSA-N
Molecular Weight 243.262 g/mol
SMILES C=1C=C(C=CC1[N+](=O)[O-])C(O)C1=CC=CC(=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.820808