| SpectraBase Spectrum ID |
9zINe2GVHLL |
| Name |
Hexhydro-2-{[(1-naphthyl)methyl]imino}-1H-azepine, monohydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
288.139326384 u |
| Formula |
C17H21ClN2 |
| InChI |
InChI=1S/C17H20N2.ClH/c1-2-11-17(18-12-5-1)19-13-15-9-6-8-14-7-3-4-10-16(14)15;/h3-4,6-10H,1-2,5,11-13H2,(H,18,19);1H |
| InChIKey |
BNWBYUMTHUYYKB-UHFFFAOYSA-N |
| Molecular Weight |
288.822 g/mol |
| SMILES |
C1CC\C(=N/CC2=CC=CC3=C2C=CC=C3)NCC1.Cl |
| Spectrum/Structure Validation Score (Raman) |
0.93009 |
![Hexhydro-2-{[(1-naphthyl)methyl]imino}-1H-azepine, monohydrochloride](/api/spectrum/9zINe2GVHLL/structure.png?h=300&w=458 "Hexhydro-2-{[(1-naphthyl)methyl]imino}-1H-azepine, monohydrochloride")
