SpectraBase Spectrum ID |
2QUUh4alXRu |
Name |
L-Proline, N-(2,5-ditrifluoromethylbenzoyl)-, dodecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
523.252112966 u |
Formula |
C26H35F6NO3 |
InChI |
InChI=1S/C26H35F6NO3/c1-2-3-4-5-6-7-8-9-10-11-17-36-24(35)22-13-12-16-33(22)23(34)20-18-19(25(27,28)29)14-15-21(20)26(30,31)32/h14-15,18,22H,2-13,16-17H2,1H3 |
InChIKey |
HBAJRRZITBISCJ-UHFFFAOYSA-N |
Molecular Weight |
523.560 g/mol |
SMILES |
C1=C(C=C(C(=C1)C(F)(F)F)C(N1CCCC1C(=O)OCCCCCCCCCCCC)=O)C(F)(F)F |