| SpectraBase Spectrum ID |
Ddda7cvDIRq |
| Name |
(2S)-2-[[2-(Methanesulfonamido)benzoyl]amino]-3-methyl-butyric acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.109292921 u |
| Formula |
C14H20N2O5S |
| InChI |
InChI=1S/C14H20N2O5S/c1-9(2)12(14(18)21-3)15-13(17)10-7-5-6-8-11(10)16-22(4,19)20/h5-9,12,16H,1-4H3,(H,15,17)/t12-/m0/s1 |
| InChIKey |
ITYZPYWWURYDOE-LBPRGKRZSA-N |
| Molecular Weight |
328.383 g/mol |
| SMILES |
C=1(NS(=O)(=O)C)C(C(N[C@](C(=O)OC)(C(C)C)[H])=O)=CC=CC1 |
![(2S)-2-[[2-(methanesulfonamido)benzoyl]amino]-3-methyl-butyric acid methyl ester](/api/spectrum/Ddda7cvDIRq/structure.png?h=300&w=458 "(2S)-2-[[2-(methanesulfonamido)benzoyl]amino]-3-methyl-butyric acid methyl ester")
