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

*Links on SpectraBase are not permalinks.
METHYL-7-NITRO-5-TRIFLUOROMETHYL-1H-BENZIMIDAZOLE-2-CARBOXYLATE
SpectraBase Compound ID AWuMzTkyzBq
InChI InChI=1S/C10H6F3N3O5/c1-21-9(17)8-14-7-5(15(8)18)2-4(10(11,12)13)3-6(7)16(19)20/h2-3,14H,1H3
InChIKey KCKGJWCEKSFJNS-UHFFFAOYSA-N
Mol Weight 305.17 g/mol
Molecular Formula C10H6F3N3O5
Exact Mass 305.025955 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 LR85yjtJWVj
Name METHYL-7-NITRO-5-TRIFLUOROMETHYL-1H-BENZIMIDAZOLE-2-CARBOXYLATE
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H6F3N3O5
InChI InChI=1S/C10H6F3N3O5/c1-21-9(17)8-14-7-5(15(8)18)2-4(10(11,12)13)3-6(7)16(19)20/h2-3,14H,1H3
InChIKey KCKGJWCEKSFJNS-UHFFFAOYSA-N
Literature Reference Author P.A.C.CAFIERO,C.S.FRENCH,M.D.MCFARLANE,R.K.MACKIE,D.M.SMITH
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1375(1997)
Literature Reference DOI 10.1039/a607378f
Molecular Weight 305.170 g/mol
Solvent CDCl3
Source File Reference UWRU9891