| SpectraBase Spectrum ID |
5PR5OzVJPcO |
| Name |
N-Tfa-L-prolylmethionine sulphoxide butyl ester |
| CAS Registry Number |
63085-20-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H25F3N2O5S |
| InChI |
InChI=1S/C16H25F3N2O5S/c1-3-4-9-26-14(23)11(7-10-27(2)25)20-13(22)12-6-5-8-21(12)15(24)16(17,18)19/h11-12H,3-10H2,1-2H3,(H,20,22)/t11-,12-,27?/m0/s1 |
| InChIKey |
LWNREUQAEAIYKS-ZUKXMZFNSA-N |
| Molecular Weight |
414.440 g/mol |
| SMILES |
N(C([C@]1(N(C(C(F)(F)F)=O)CCC1)[H])=O)[C@](C(=O)OCCCC)(CCS(=O)C)[H] |
| SPLASH |
splash10-014i-8931000000-d0804b484f7e3966e917 |
| Source of Spectrum |
W5-1989-9627-1 |
| Synonyms |
Butyl (2S)-4-(methylsulfinyl)-2-({[(2S)-1-(trifluoroacetyl)pyrrolidinyl]carbonyl}amino)butanoate |
| Wiley ID |
1375170 |
