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

*Links on SpectraBase are not permalinks.

4-METHYL-7-[(2,6-DIFLUOROPHENYL)-IMINO]-PERHYDRO-[1,4]-DIAZEPIN-5-ONE;1-METHYL-7-[(2,6-DIFLUOROPHENYL)-IMINO]-PERHYDRO-[1,4]-DIAZEPIN-5-ONE;#10A+10B

View entire compound with spectra: 1 NMR

4-METHYL-7-[(2,6-DIFLUOROPHENYL)-IMINO]-PERHYDRO-[1,4]-DIAZEPIN-5-ONE;1-METHYL-7-[(2,6-DIFLUOROPHENYL)-IMINO]-PERHYDRO-[1,4]-DIAZEPIN-5-ONE;#10A+10B
SpectraBase Compound ID 5lcvr4H4Txp
InChI InChI=1S/2C12H13F2N3O/c1-17-6-5-15-11(18)7-10(17)16-12-8(13)3-2-4-9(12)14;1-17-6-5-15-10(7-11(17)18)16-12-8(13)3-2-4-9(12)14/h2-4H,5-7H2,1H3,(H,15,18);2-4H,5-7H2,1H3,(H,15,16)/b16-10-;
InChIKey YSSKELZAULDFDQ-HYMQDMCPSA-N
Mol Weight 506.51 g/mol
Molecular Formula C24H26F4N6O2
Exact Mass 506.205337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID LYKjGsExLKa
Name 4-METHYL-7-[(2,6-DIFLUOROPHENYL)-IMINO]-PERHYDRO-[1,4]-DIAZEPIN-5-ONE;1-METHYL-7-[(2,6-DIFLUOROPHENYL)-IMINO]-PERHYDRO-[1,4]-DIAZEPIN-5-ONE;#10A+10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26F4N6O2
InChI InChI=1S/2C12H13F2N3O/c1-17-6-5-15-11(18)7-10(17)16-12-8(13)3-2-4-9(12)14;1-17-6-5-15-10(7-11(17)18)16-12-8(13)3-2-4-9(12)14/h2-4H,5-7H2,1H3,(H,15,18);2-4H,5-7H2,1H3,(H,15,16)/b16-10-;
InChIKey YSSKELZAULDFDQ-HYMQDMCPSA-N
Literature Reference Author M.SHTAIWI,C.WENTRUP
Literature Reference Citation J.ORG.CHEM.,67,8558(2002)
Literature Reference DOI 10.1021/jo026275+
Molecular Weight 506.503 g/mol
Solvent CDCl3
Source File Reference UWVN23735