3-(2-Oxo-2,3-dihydro-1,3-benzoxazol-3-yl)propanoic acid

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Systematic / IUPAC Name: 3-(2-Oxo-1,3-benzoxazol-3(2H)-yl)propanoic acid

ID: Reference4345

Other Names: 3(2H)-Benzoxazolepropanoic acid, 2-oxo-;
3-(2-Carboxyethyl)-2-benzoxazolinone;
3-(2-Oxo-3-hydrobenzoxazol-3-yl)propanoic acid;
3-(2-Oxobenzo[d]oxazol-3(2H)-yl)propanoic acid;
3-(2-Oxo-benzooxazol-3-yl)propionic acid

Formula: C10H9NO4

Spectral Data

3-(2-Oxo-2,3-dihydro-1,3-benzoxazol-3-yl)propanoic acid 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 Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 228
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/22/2016 3:34:28 PM
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Identificators

InChI InChI=1S/C10H9NO4/c12-9(13)5-6-11-7-3-1-2-4-8(7)15-10(11)14/h1-4H,5-6H2,(H,12,13)
InChI Key BMLRDVCKJXMASM-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)O
CAS 13610598
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Other Names 3(2H)-Benzoxazolepropanoic acid, 2-oxo-;
3-(2-Carboxyethyl)-2-benzoxazolinone;
3-(2-Oxo-3-hydrobenzoxazol-3-yl)propanoic acid;
3-(2-Oxobenzo[d]oxazol-3(2H)-yl)propanoic acid;
3-(2-Oxo-benzooxazol-3-yl)propionic acid

In Other Databases

PubChem 720147
ChemSpider 628580