SpectraBase Spectrum ID |
15964gTxZt1 |
Name |
L-Alanine, N-(4-rtifluoromethylbenzoyl)-, dodecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
429.249078445 u |
Formula |
C23H34F3NO3 |
InChI |
InChI=1S/C23H34F3NO3/c1-3-4-5-6-7-8-9-10-11-12-17-30-22(29)18(2)27-21(28)19-13-15-20(16-14-19)23(24,25)26/h13-16,18H,3-12,17H2,1-2H3,(H,27,28) |
InChIKey |
VFTXNKIMUOQTBM-UHFFFAOYSA-N |
Molecular Weight |
429.524 g/mol |
SMILES |
C1=CC(=CC=C1C(NC(C(OCCCCCCCCCCCC)=O)C)=O)C(F)(F)F |