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2-(Alloxycarbonyl)-1-benzyl-5-chloro-1H-1,2-diazepine-3-carboxylic acid methyl ester
SpectraBase Compound ID 55301rSGNOD
InChI InChI=1S/C18H23ClN2O4/c1-3-11-25-18(23)21-16(17(22)24-2)12-15(19)9-10-20(21)13-14-7-5-4-6-8-14/h3-8,15-16H,1,9-13H2,2H3
InChIKey AGJOKOQLPBUOJB-UHFFFAOYSA-N
Mol Weight 366.85 g/mol
Molecular Formula C18H23ClN2O4
Exact Mass 366.134635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sSUom5C4p8
Name 2-(Alloxycarbonyl)-1-benzyl-5-chloro-1H-1,2-diazepine-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23ClN2O4
InChI InChI=1S/C18H23ClN2O4/c1-3-11-25-18(23)21-16(17(22)24-2)12-15(19)9-10-20(21)13-14-7-5-4-6-8-14/h3-8,15-16H,1,9-13H2,2H3
InChIKey AGJOKOQLPBUOJB-UHFFFAOYSA-N
Molecular Weight 366.845 g/mol
SMILES C1(N(N(CCC(C1)Cl)Cc1ccccc1)C(=O)OCC=C)C(=O)OC
SPLASH splash10-00kf-8029000000-9344b73b10d836ab01e9
Source of Spectrum F-49-8621-43
Synonyms 1-Allyl 7-methyl 2-benzyl-5-chlorohexahydro-1H-1,2-diazepine-1,7-dicarboxylate 2-(Alloxycarbonyl)-1-benzyl-5-chloro-1H-1,2-diazepane-3-carboxylic acid methyl ester
Wiley ID 788300