| SpectraBase Spectrum ID |
FAFRudzlauh |
| Name |
Benzenethanamine, 3-benzyloxy-2-fluoro-.beta.-hydroxy-4-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.127071604 u |
| Formula |
C16H18FNO3 |
| InChI |
InChI=1S/C16H18FNO3/c1-20-14-8-7-12(13(19)9-18)15(17)16(14)21-10-11-5-3-2-4-6-11/h2-8,13,19H,9-10,18H2,1H3 |
| InChIKey |
HCFJLGHSEOMCGY-UHFFFAOYSA-N |
| Molecular Weight |
291.322 g/mol |
| SMILES |
C1(=C(C(=C(C=C1)OC)OCC1=CC=CC=C1)F)C(O)CN |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921589 |
