| SpectraBase Spectrum ID |
I6z1puRUAcj |
| Name |
L-Homocysteine, S-[3-butoxy-3-oxo-2-[(trifluoroacetyl)amino]propyl]-N-(trifluoroacetyl)-, butyl ester, (R)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
526.157226776 u |
| Formula |
C19H28F6N2O6S |
| InChI |
InChI=1S/C19H28F6N2O6S/c1-3-5-8-32-14(28)12(26-16(30)18(20,21)22)7-10-34-11-13(15(29)33-9-6-4-2)27-17(31)19(23,24)25/h12-13H,3-11H2,1-2H3,(H,26,30)(H,27,31) |
| InChIKey |
RKBMKRLGTVFFDO-UHFFFAOYSA-N |
| Molecular Weight |
526.491 g/mol |
| SMILES |
C(NC(C(F)(F)F)=O)(C(OCCCC)=O)CCSCC(NC(C(F)(F)F)=O)C(OCCCC)=O |
![L-Homocysteine, S-[3-butoxy-3-oxo-2-[(trifluoroacetyl)amino]propyl]-N-(trifluoroacetyl)-, butyl ester, (R)-](/api/spectrum/I6z1puRUAcj/structure.png?h=300&w=458 "L-Homocysteine, S-[3-butoxy-3-oxo-2-[(trifluoroacetyl)amino]propyl]-N-(trifluoroacetyl)-, butyl ester, (R)-")
