Methyl (6S)-5-benzoyl-3-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate

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Systematic / IUPAC Name: Methyl (6S)-5-benzoyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate

ID: Reference9321

Other Names: 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 5-benzoyl-4,5,6,7-tetrahydro-3-methyl-, methyl ester, (6S)-;
NAT22-374084

Formula: C16H17N3O3

Spectral Data

Methyl (6S)-5-benzoyl-3-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-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 Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1954
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 1/24/2020 11:50:04 AM
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Identificators

InChI InChI=1S/C16H17N3O3/c1-18-10-17-12-8-13(16(21)22-2)19(9-14(12)18)15(20)11-6-4-3-5-7-11/h3-7,10,13H,8-9H2,1-2H3/t13-/m0/s1
InChI Key QMGQBULJTYFHRX-ZDUSSCGKSA-N
Canonical SMILES CN1C=NC2=C1CN(C(C2)C(=O)OC)C(=O)C3=CC=CC=C3
CAS
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Other Names 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 5-benzoyl-4,5,6,7-tetrahydro-3-methyl-, methyl ester, (6S)-;
NAT22-374084

In Other Databases

PubChem 26745534
ChemSpider 21388472