SpectraBase Spectrum ID |
HlKYXK3KNHs |
Name |
2-Phenyl-1H-1-benzazepin-5-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.099714042 u |
Formula |
C16H13NO |
InChI |
InChI=1S/C16H13NO/c18-16-11-10-14(12-6-2-1-3-7-12)17-15-9-5-4-8-13(15)16/h1-11,17-18H |
InChIKey |
MGTIZNBCJFWPIJ-UHFFFAOYSA-N |
Molecular Weight |
235.286 g/mol |
SMILES |
C=1(NC=2C(C(=CC1)O)=CC=CC2)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940846 |