Boc-β-alanine

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Systematic / IUPAC Name: N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-β-alanine

ID: Reference1322

Other Names: β-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-;
3-[(tert-Butoxy)carbonylamino]propanoic acid;
N-[(1,1-Dimethylethoxy)carbonyl]-β-alanine;
β-Alanine, tert-butyloxycarbonyl;
3-[(2-Methylpropan-2-yl)oxycarbonylamino]propanoic acid

Formula: C8H15NO4

Spectral Data

Boc-β-alanine 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 1
No. of Spectra 71
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/4/2014 9:49:30 AM
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Identificators

InChI InChI=1S/C8H15NO4/c1-8(2,3)13-7(12)9-5-4-6(10)11/h4-5H2,1-3H3,(H,9,12)(H,10,11)
InChI Key WCFJUSRQHZPVKY-UHFFFAOYSA-N
Canonical SMILES CC(C)(C)OC(=O)NCCC(=O)O
CAS 3303842
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Other Names β-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-;
3-[(tert-Butoxy)carbonylamino]propanoic acid;
N-[(1,1-Dimethylethoxy)carbonyl]-β-alanine;
β-Alanine, tert-butyloxycarbonyl;
3-[(2-Methylpropan-2-yl)oxycarbonylamino]propanoic acid;
N-(tert-Butoxycarbonyl)-β-alanine

In Other Databases

ChemSpider 69265
ChemIDPlus 003303842
PubChem 76809