4-{[(3-Methyl-2-thienyl)methyl]amino}-4-oxobutanoic acid

enlarge

Systematic / IUPAC Name: 4-{[(3-Methyl-2-thienyl)methyl]amino}-4-oxobutanoic acid

ID: Reference4814

Other Names: Butanoic acid, 4-{[(3-methyl-2-thienyl)methyl]amino}-4-oxo-

Formula: C10H13NO3S

Spectral Data

4-{[(3-Methyl-2-thienyl)methyl]amino}-4-oxobutanoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 5/12/2016 9:01:09 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C10H13NO3S/c1-7-4-5-15-8(7)6-11-9(12)2-3-10(13)14/h4-5H,2-3,6H2,1H3,(H,11,12)(H,13,14)
InChI Key YTZDJWXZPIYUGQ-UHFFFAOYSA-N
Canonical SMILES CC1=C(SC=C1)CNC(=O)CCC(=O)O
CAS
Splash
Other Names Butanoic acid, 4-{[(3-methyl-2-thienyl)methyl]amino}-4-oxo-

In Other Databases

ChemSpider 2089935
PubChem 2811524