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(5-N-Methyl)-11-aniline-5H-dibenzo[b,e][1,4]diazepines
SpectraBase Compound ID HTYYENoM7T
InChI InChI=1S/C20H17N3/c1-23-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)22-17-7-3-5-9-19(17)23/h2-13H,21H2,1H3
InChIKey NCVLGGZVXDYCJO-UHFFFAOYSA-N
Mol Weight 299.38 g/mol
Molecular Formula C20H17N3
Exact Mass 299.142248 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1wwHTvcEb42
Name (5-N-Methyl)-11-aniline-5H-dibenzo[B,E][1,4]diazepines
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.142247559 u
Formula C20H17N3
InChI InChI=1S/C20H17N3/c1-23-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)22-17-7-3-5-9-19(17)23/h2-13H,21H2,1H3
InChIKey NCVLGGZVXDYCJO-UHFFFAOYSA-N
SMILES C1(=NC2=C(N(C3=C1C=CC=C3)C)C=CC=C2)C1=CC=C(C=C1)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966781