For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(N,N'-dicyclohexylcarbamimidoyl) 6-nitro-2-oxidanylidene-chromene-3-carboxylate
SpectraBase Compound ID 99gZpzu9LjQ
InChI InChI=1S/C23H27N3O6/c27-21-19(14-15-13-18(26(29)30)11-12-20(15)31-21)22(28)32-23(24-16-7-3-1-4-8-16)25-17-9-5-2-6-10-17/h11-14,16-17H,1-10H2,(H,24,25)
InChIKey YUQOLVDHDOTBBQ-UHFFFAOYSA-N
Mol Weight 441.48 g/mol
Molecular Formula C23H27N3O6
Exact Mass 441.189986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5j1iF7JN9Fp
Name (N,N'-dicyclohexylcarbamimidoyl) 6-nitro-2-oxidanylidene-chromene-3-carboxylate
Alternate Name(s) (N,N'-dicyclohexylcarbamimidoyl) 6-nitro-2-oxo-chromene-3-carboxylate 2-keto-6-nitro-chromene-3-carboxylic acid (N,N'-dicyclohexylamidino) ester 6-Nitro-2-oxo-1-benzopyran-3-carboxylic acid [(cyclohexylamino)-cyclohexyliminomethyl] ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27N3O6
InChI InChI=1S/C23H27N3O6/c27-21-19(14-15-13-18(26(29)30)11-12-20(15)31-21)22(28)32-23(24-16-7-3-1-4-8-16)25-17-9-5-2-6-10-17/h11-14,16-17H,1-10H2,(H,24,25)
InChIKey YUQOLVDHDOTBBQ-UHFFFAOYSA-N
Molecular Weight 441.484 g/mol
SMILES N(\C(OC(C=1C(Oc2c(C1)cc(N(=O)=O)cc2)=O)=O)=N/C1CCCCC1)C1CCCCC1
SPLASH splash10-014s-2090000000-9319aba41006c3420c9b
Source of Spectrum Y-32-576-7
Wiley ID 1385054