SpectraBase Spectrum ID |
8BupqnhRPDn |
Name |
2,3,4,5-Tetrahydro-1H-2-benzazepine, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
189.115364106 u |
Formula |
C12H15NO |
InChI |
InChI=1S/C12H15NO/c1-10(14)13-8-4-7-11-5-2-3-6-12(11)9-13/h2-3,5-6H,4,7-9H2,1H3 |
InChIKey |
IVYYINUFLIWZOE-UHFFFAOYSA-N |
Molecular Weight |
189.258 g/mol |
SMILES |
C1N(CC2=C(CC1)C=CC=C2)C(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851379 |