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

*Links on SpectraBase are not permalinks.
4-(2,5-Dimethoxyanilino)-4-oxobutanoic acid
SpectraBase Compound ID JCmUA5hYkwm
InChI InChI=1S/C12H15NO5/c1-17-8-3-4-10(18-2)9(7-8)13-11(14)5-6-12(15)16/h3-4,7H,5-6H2,1-2H3,(H,13,14)(H,15,16)
InChIKey XQQBLMMDNXWGEB-UHFFFAOYSA-N
Mol Weight 253.25 g/mol
Molecular Formula C12H15NO5
Exact Mass 253.095023 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 7Ghky5lTgEc
Name 4-(2,5-Dimethoxyanilino)-4-oxobutanoic acid
Alternate Name(s) 4-(2,5-dimethoxyanilino)-4-keto-butyric acid 4-[(2,5-dimethoxyphenyl)amino]-4-oxidanylidene-butanoic acid
CAS Registry Number 284488-70-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO5
InChI InChI=1S/C12H15NO5/c1-17-8-3-4-10(18-2)9(7-8)13-11(14)5-6-12(15)16/h3-4,7H,5-6H2,1-2H3,(H,13,14)(H,15,16)
InChIKey XQQBLMMDNXWGEB-UHFFFAOYSA-N
Molecular Weight 253.254 g/mol
SMILES N(c1cc(OC)ccc1OC)C(CCC(=O)O)=O
SPLASH splash10-0f79-3920000000-39c8b4a195de2866bf7a
Source of Spectrum AD-0-2532-0
Wiley ID 1433212