SpectraBase Spectrum ID |
BbD33nIj5Um |
Name |
D-Alanine, N-(4-anisoyl)-, dodecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
391.272258671 u |
Formula |
C23H37NO4 |
InChI |
InChI=1S/C23H37NO4/c1-4-5-6-7-8-9-10-11-12-13-18-28-23(26)19(2)24-22(25)20-14-16-21(27-3)17-15-20/h14-17,19H,4-13,18H2,1-3H3,(H,24,25) |
InChIKey |
FRVKJBPYBQJXOV-UHFFFAOYSA-N |
Molecular Weight |
391.552 g/mol |
SMILES |
C(NC(=O)C=1C=CC(OC)=CC1)(C(OCCCCCCCCCCCC)=O)C |