N-Tigloylglycine

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Systematic / IUPAC Name: N-[(2E)-2-Methyl-2-butenoyl]glycine

ID: Reference1383

Other Names: N-[(2E)-2-Methyl-1-oxo-2-buten-1-yl]glycine;
Glycine, N-(2-methyl-1-oxo-2-butenyl), (E)-;
Tiglylglycine

Formula: C7H11NO3

Class: Endogenous Metabolites

Spectral Data

N-Tigloylglycine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 146
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/4/2014 7:42:06 AM
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Identificators

InChI InChI=1S/C7H11NO3/c1-3-5(2)7(11)8-4-6(9)10/h3H,4H2,1-2H3,(H,8,11)(H,9,10)/b5-3+
InChI Key WRUSVQOKJIDBLP-HWKANZROSA-N
Canonical SMILES CC=C(C)C(=O)NCC(=O)O
CAS 35842456
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Other Names N-[(2E)-2-Methyl-1-oxo-2-buten-1-yl]glycine;
Glycine, N-(2-methyl-1-oxo-2-butenyl), (E)-;
Tiglylglycine

In Other Databases

ChemSpider 4945715
PubChem 6441567
ChemIDPlus 035842456
ChEBI CHEBI:73018
HMDb HMDB00959