SpectraBase Spectrum ID |
8dK4A5Rlwus |
Name |
Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 2-fluorophenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
403.158371732 u |
Formula |
C25H22FNO3 |
InChI |
InChI=1S/C25H22FNO3/c26-22-13-7-8-14-23(22)30-25(29)16-15-24(28)27(19-21-11-5-2-6-12-21)18-17-20-9-3-1-4-10-20/h1-16H,17-19H2/b16-15+ |
InChIKey |
HAUSSUIWYOGCIB-FOCLMDBBSA-N |
Molecular Weight |
403.453 g/mol |
SMILES |
C1=CC=C(C=C1)CCN(C(\C=C\C(OC1=C(C=CC=C1)F)=O)=O)CC1=CC=CC=C1 |