| SpectraBase Spectrum ID |
JinGXx7Tfuf |
| Name |
(S)-Methyl 1-[(S)-(hydroxycarbonyl)propyl]-1H-isoquinoliune-2-carboxylate |
| Alternate Name(s) |
Methyl 1-[(hydroxycarbonyl)propyl]-1H-isoquinoliune-2-carboxylate
(S)-2-((S)-2-(methoxycarbonyl)-1,2-dihydroisoquinolin-1-yl)butanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H17NO4 |
| InChI |
InChI=1S/C15H17NO4/c1-3-11(14(17)18)13-12-7-5-4-6-10(12)8-9-16(13)15(19)20-2/h4-9,11,13H,3H2,1-2H3,(H,17,18)/t11-,13-/m0/s1 |
| InChIKey |
IYNYDILBSMGCCK-AAEUAGOBSA-N |
| Molecular Weight |
275.304 g/mol |
| SMILES |
OC([C@]([C@@]1(N(C(=O)OC)C=Cc2ccccc12)[H])(CC)[H])=O |
| SPLASH |
splash10-0ktr-2900000000-76aa3f96cb3ca6ffa343 |
| Source of Spectrum |
F5-6-2808-3b |
| Wiley ID |
1733513 |
![(S)-Methyl 1-[(S)-(hydroxycarbonyl)propyl]-1H-isoquinoliune-2-carboxylate](/api/spectrum/JinGXx7Tfuf/structure.png?h=300&w=458 "(S)-Methyl 1-[(S)-(hydroxycarbonyl)propyl]-1H-isoquinoliune-2-carboxylate")
