| SpectraBase Spectrum ID |
94xZQVp8Vqo |
| Name |
(S)-2-(1,3-dioxoisoindolin-2-yl)pentanedioic acid |
| Appearance |
Colorless crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.058637072 u |
| Formula |
C13H11NO6 |
| InChI |
InChI=1S/C13H11NO6/c15-10(16)6-5-9(13(19)20)14-11(17)7-3-1-2-4-8(7)12(14)18/h1-4,9H,5-6H2,(H,15,16)(H,19,20)/t9-/m0/s1 |
| InChIKey |
FEFFSKLJNYRHQN-VIFPVBQESA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202108814 |
| Molecular Weight |
277.232 g/mol |
| Quality |
1000 |
| SMILES |
OC([C@](CCC(=O)O)(N1C(=O)C2=CC=CC=C2C1=O)[H])=O |
| SPLASH |
splash10-000i-2920000000-15a821c45ee93949680f |
| Source of Spectrum |
ACI-60-SM44-14a (DOI: 10.1002/anie.202108814) |
| Thin-Layer Chromatography |
0.28 (ethyl acetate/cyclohexane, 1:1) |
| Wiley ID |
1891329 |
