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Cyclohexanecarboxylic acid (3-nitro-dibenzo[b,f]oxepin-1-yl)-amide
SpectraBase Compound ID Cq6GE8VxLCl
InChI InChI=1S/C21H20N2O4/c24-21(15-7-2-1-3-8-15)22-18-12-16(23(25)26)13-20-17(18)11-10-14-6-4-5-9-19(14)27-20/h4-6,9-13,15H,1-3,7-8H2,(H,22,24)
InChIKey VFJKEADQUDOIIR-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IY6AakNLYrv
Name Cyclohexanecarboxylic acid (3-nitro-dibenzo[b,f]oxepin-1-yl)-amide
Alternate Name(s) N-(2-nitro-4-benzo[b][1]benzoxepinyl)cyclohexanecarboxamide N-(2-nitrobenzo[b][1]benzoxepin-4-yl)cyclohexanecarboxamide N-(3-Nitrodibenzo[b,f]oxepin-1-yl)cyclohexanecarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c24-21(15-7-2-1-3-8-15)22-18-12-16(23(25)26)13-20-17(18)11-10-14-6-4-5-9-19(14)27-20/h4-6,9-13,15H,1-3,7-8H2,(H,22,24)
InChIKey VFJKEADQUDOIIR-UHFFFAOYSA-N
Molecular Weight 364.401 g/mol
SMILES N(c1c2C=Cc3c(Oc2cc(N(=O)=O)c1)cccc3)C(=O)C1CCCCC1
SPLASH splash10-053r-9320000000-b23709b0e49228859e5b
Wiley ID 1458897