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Methyl 5-(ethoxycarbonyl)-(R)-6-[(R)-2'-nitro-1'-phenylethyl]-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate
SpectraBase Compound ID LH0V8cSKWP8
InChI InChI=1S/C19H22N4O6/c1-3-29-18(25)22-11-16-15(20-12-21-16)9-19(22,17(24)28-2)14(10-23(26)27)13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3,(H,20,21)/t14-,19+/m0/s1
InChIKey SVXBFSKSWSCTKS-IFXJQAMLSA-N
Mol Weight 402.41 g/mol
Molecular Formula C19H22N4O6
Exact Mass 402.153934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOhuHdYAf4D
Name Methyl 5-(ethoxycarbonyl)-(R)-6-[(R)-2'-nitro-1'-phenylethyl]-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N4O6
InChI InChI=1S/C19H22N4O6/c1-3-29-18(25)22-11-16-15(20-12-21-16)9-19(22,17(24)28-2)14(10-23(26)27)13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3,(H,20,21)/t14-,19+/m0/s1
InChIKey SVXBFSKSWSCTKS-IFXJQAMLSA-N
Molecular Weight 402.407 g/mol
SMILES [nH]1cnc2c1CN([C@](C2)([C@@](CN(=O)=O)(c1ccccc1)[H])C(=O)OC)C(=O)OCC
SPLASH splash10-0fl3-4960000000-03aabe4c862a25ec8d49
Source of Spectrum Y4-40-921-7
Synonyms 5-Ethyl 6-methyl (6R)-6-[(1R)-2-nitro-1-phenylethyl]-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5,6-dicarboxylate Methyl 5-(ethoxycarbonyl)-6-[2'-nitro-1'-phenylethyl]-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate
Wiley ID 1567203