| SpectraBase Spectrum ID |
9E3DmHtcenD |
| Name |
(S)-2-Bromo-4,5-dimethoxyphentlalanine Methyl Ester Hydrotrifluoroacetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17BrF3NO6 |
| InChI |
InChI=1S/C12H16BrNO4.C2HF3O2/c1-16-10-5-7(4-9(14)12(15)18-3)8(13)6-11(10)17-2;3-2(4,5)1(6)7/h5-6,9H,4,14H2,1-3H3;(H,6,7)/t9-;/m0./s1 |
| InChIKey |
ZPPGZPGAQWINRH-FVGYRXGTSA-N |
| Molecular Weight |
432.190 g/mol |
| SMILES |
N[C@](C(=O)OC)(Cc1c(cc(c(c1)OC)OC)Br)[H].OC(C(F)(F)F)=O |
| SPLASH |
splash10-001r-2090000000-81b5b2fc7c78b793cef0 |
| Source of Spectrum |
J-63-4943-11 |
| Synonyms |
Methyl (2S)-2-amino-3-(2-bromo-4,5-dimethoxyphenyl)propanoate trifluoroacetate |
| Wiley ID |
1381895 |
