| SpectraBase Spectrum ID |
Crat8fcRbwg |
| Name |
1-(3,6-Dihydro-1(2H)-pyridinyl)-3-(2-methylphenoxy)-2-propanol, methyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.172878983 u |
| Formula |
C16H23NO2 |
| InChI |
InChI=1S/C16H23NO2/c1-14-8-4-5-9-16(14)19-13-15(18-2)12-17-10-6-3-7-11-17/h3-6,8-9,15H,7,10-13H2,1-2H3 |
| InChIKey |
IYBDYEMMGHIOQW-UHFFFAOYSA-N |
| Molecular Weight |
261.365 g/mol |
| SMILES |
C(OC1=C(C)C=CC=C1)C(CN1CCC=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95776 |
