| SpectraBase Spectrum ID |
Hq4xQwfbq4C |
| Name |
Phencyclidine-m (di-ho-) iso-1 2ac P1259 |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.209658414 u |
| Formula |
C21H29NO4 |
| InChI |
InChI=1S/C21H29NO4/c1-16(23)25-19-8-12-21(13-9-19,18-6-4-3-5-7-18)22-14-10-20(11-15-22)26-17(2)24/h3-7,19-20H,8-15H2,1-2H3 |
| InChIKey |
OYBADLSARNJSKX-UHFFFAOYSA-N |
| Molecular Weight |
359.466 g/mol |
| SMILES |
CC(OC1CCC(CC1)(C1=CC=CC=C1)N1CCC(OC(C)=O)CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894394 |
