| SpectraBase Spectrum ID |
mLjE5sluUu |
| Name |
Dfbdb N-(3-methoxybenzyl) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.148949863 u |
| Formula |
C19H21F2NO3 |
| InChI |
InChI=1S/C19H21F2NO3/c1-3-15(22-12-14-5-4-6-16(10-14)23-2)9-13-7-8-17-18(11-13)25-19(20,21)24-17/h4-8,10-11,15,22H,3,9,12H2,1-2H3 |
| InChIKey |
NIBKHKPVADGMQR-UHFFFAOYSA-N |
| Molecular Weight |
349.378 g/mol |
| SMILES |
C1(OC=2C(O1)=CC=C(C2)CC(NCC=1C=C(C=CC1)OC)CC)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937101 |
