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N,N-DIMETHYL-N-(3-(BENZOYL-4-PHENOXY))-N-N-DODECYLAMMONIUM-BROMIDE

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N,N-DIMETHYL-N-(3-(BENZOYL-4-PHENOXY))-N-N-DODECYLAMMONIUM-BROMIDE
SpectraBase Compound ID CeVjStca6cU
InChI InChI=1S/C30H46NO2.BrH/c1-4-5-6-7-8-9-10-11-12-16-24-31(2,3)25-17-26-33-29-22-20-28(21-23-29)30(32)27-18-14-13-15-19-27;/h13-15,18-23H,4-12,16-17,24-26H2,1-3H3;1H/q+1;/p-1
InChIKey BEDASJXNVCDKJO-UHFFFAOYSA-M
Mol Weight 532.6 g/mol
Molecular Formula C30H46BrNO2
Exact Mass 531.271193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9upduDX8Pc5
Name N,N-DIMETHYL-N-(3-(BENZOYL-4-PHENOXY))-N-N-DODECYLAMMONIUM-BROMIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46BrNO2
InChI InChI=1S/C30H46NO2.BrH/c1-4-5-6-7-8-9-10-11-12-16-24-31(2,3)25-17-26-33-29-22-20-28(21-23-29)30(32)27-18-14-13-15-19-27;/h13-15,18-23H,4-12,16-17,24-26H2,1-3H3;1H/q+1;/p-1
InChIKey BEDASJXNVCDKJO-UHFFFAOYSA-M
Literature Reference Author C.ANSELMI,M.CENTINI,M.SCOTTON,A.SEGA
Literature Reference Citation CAN.J.CHEM.,69,913(1991)
Literature Reference DOI 10.1139/v91-135
Molecular Weight 532.605 g/mol
Solvent CDCl3
Source File Reference UWTS1949