2-[(2-{[(Benzyloxy)carbonyl]amino}-3-methylpentanoyl)amino]acetic acid

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Systematic / IUPAC Name: N-[(Benzyloxy)carbonyl]isoleucylglycine

ID: Reference4501

Other Names: 2-(2-{[(Benzyloxy)carbonyl]amino}-3-methylpentanamido)acetic acid;
Acetic acid, 2-(2-benzyloxycarbonylamino-3-methylpentanoylamino)-;
Glycine, N-[(phenylmethoxy)carbonyl]isoleucyl-

Formula: C16H22N2O5

Spectral Data

2-[(2-{[(Benzyloxy)carbonyl]amino}-3-methylpentanoyl)amino]acetic 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 1
No. of Spectra 84
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/11/2016 12:17:24 PM
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Identificators

InChI InChI=1S/C16H22N2O5/c1-3-11(2)14(15(21)17-9-13(19)20)18-16(22)23-10-12-7-5-4-6-8-12/h4-8,11,14H,3,9-10H2,1-2H3,(H,17,21)(H,18,22)(H,19,20)
InChI Key RWAYODJQGJVQGX-UHFFFAOYSA-N
Canonical SMILES CCC(C)C(C(=O)NCC(=O)O)NC(=O)OCC1=CC=CC=C1
CAS
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Other Names 2-(2-{[(Benzyloxy)carbonyl]amino}-3-methylpentanamido)acetic acid;
Acetic acid, 2-(2-benzyloxycarbonylamino-3-methylpentanoylamino)-;
Glycine, N-[(phenylmethoxy)carbonyl]isoleucyl-

In Other Databases

PubChem 433608
ChemSpider 383461