For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-isoindole-2-propanoic acid, 2,3-dihydro-5-methyl-1,3-dioxo-
SpectraBase Compound ID 1lTFNbBU5g7
InChI InChI=1S/C12H11NO4/c1-7-2-3-8-9(6-7)12(17)13(11(8)16)5-4-10(14)15/h2-3,6H,4-5H2,1H3,(H,14,15)
InChIKey AWBOQSIIXFLDPI-UHFFFAOYSA-N
Mol Weight 233.22 g/mol
Molecular Formula C12H11NO4
Exact Mass 233.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Hybkc0xrtte
Name 3-(5-Methyl-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO4
InChI InChI=1S/C12H11NO4/c1-7-2-3-8-9(6-7)12(17)13(11(8)16)5-4-10(14)15/h2-3,6H,4-5H2,1H3,(H,14,15)
InChIKey AWBOQSIIXFLDPI-UHFFFAOYSA-N
Molecular Weight 233.223 g/mol
SMILES OC(CCN1C(c2cc(C)ccc2C1=O)=O)=O
SPLASH splash10-0079-3900000000-b04c8989d598375a645b
Synonyms 3-(1,3-diketo-5-methyl-isoindolin-2-yl)propionic acid 3-(5-Methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid 3-(5-Methyl-1,3-dioxo-2-isoindolyl)propanoic acid 3-(5-Methyl-1,3-dioxo-isoindolin-2-yl)propanoic acid 3-(5-Methyl-1,3-dioxoisoindol-2-yl)propanoic acid 3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid
Wiley ID 1449756