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

*Links on SpectraBase are not permalinks.

(NO2)3-OCT-MC-6

View entire compound with spectra: 1 NMR

(NO2)3-OCT-MC-6
SpectraBase Compound ID 9asIUuxIz6c
InChI InChI=1S/C54H71N3O14/c1-3-5-7-9-11-13-18-68-52-42-30-40-16-15-17-41-31-43-35-49(56(60)61)37-45(53(43)69-19-14-12-10-8-6-4-2)33-47-39-50(57(62)63)38-46(32-44(52)36-48(34-42)55(58)59)54(47)71-29-27-67-25-23-65-21-20-64-22-24-66-26-28-70-51(40)41/h15-17,34-39H,3-14,18-33H2,1-2H3
InChIKey LCJWQWPGCZRQPB-UHFFFAOYSA-N
Mol Weight 986.2 g/mol
Molecular Formula C54H71N3O14
Exact Mass 985.493604 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 EKwyse3O2ZA
Name (NO2)3-OCT-MC-6
Compound Number C2O1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H71N3O14
InChI InChI=1S/C54H71N3O14/c1-3-5-7-9-11-13-18-68-52-42-30-40-16-15-17-41-31-43-35-49(56(60)61)37-45(53(43)69-19-14-12-10-8-6-4-2)33-47-39-50(57(62)63)38-46(32-44(52)36-48(34-42)55(58)59)54(47)71-29-27-67-25-23-65-21-20-64-22-24-66-26-28-70-51(40)41/h15-17,34-39H,3-14,18-33H2,1-2H3
InChIKey LCJWQWPGCZRQPB-UHFFFAOYSA-N
Literature Reference Author C.K.JANKOWSKI,M.R.V.CALSTEREN,N.AYCHET,J.F.DOZOL,C.MOULIN,C. LAMOUROUX
Literature Reference Citation CAN.J.CHEM.,83,1098(2005)
Literature Reference DOI 10.1139/v05-126
Molecular Weight 986.169 g/mol
Solvent CDCl3
Source File Reference UWLU30432