Benzyl 2-oxohexahydrocyclopropa[d]imidazole-1-carboxylate

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Systematic / IUPAC Name: Benzyl 3-oxo-2,4-diazabicyclo[3.1.0]hexane-2-carboxylate

ID: Reference4047

Other Names: 2,4-Diazabicyclo[3.1.0]hexane-2-carboxylic acid, 3-oxo-, phenylmethyl ester

Formula: C12H12N2O3

Spectral Data

Benzyl 2-oxohexahydrocyclopropa[d]imidazole-1-carboxylate 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 159
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/3/2016 10:47:41 AM
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Identificators

InChI InChI=1S/C12H12N2O3/c15-11-13-9-6-10(9)14(11)12(16)17-7-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,13,15)
InChI Key MTQBCNWSXOYUJM-UHFFFAOYSA-N
Canonical SMILES C1C2C1N(C(=O)N2)C(=O)OCC3=CC=CC=C3
CAS
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Other Names 2,4-Diazabicyclo[3.1.0]hexane-2-carboxylic acid, 3-oxo-, phenylmethyl ester

In Other Databases

PubChem 2802741
ChemSpider 2081417