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4,4',4''-(1,3,5-TRIAZINE-2,4,6-TRIYLTRIIMINO)-TRIS-BENZOIC-ACID-1,1',1''-TRIETHYLESTER

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4,4',4''-(1,3,5-TRIAZINE-2,4,6-TRIYLTRIIMINO)-TRIS-BENZOIC-ACID-1,1',1''-TRIETHYLESTER
SpectraBase Compound ID 1I56Pbn42rM
InChI InChI=1S/C30H30N6O6/c1-4-40-25(37)19-7-13-22(14-8-19)31-28-34-29(32-23-15-9-20(10-16-23)26(38)41-5-2)36-30(35-28)33-24-17-11-21(12-18-24)27(39)42-6-3/h7-18H,4-6H2,1-3H3,(H3,31,32,33,34,35,36)
InChIKey UHGOHGRPESTFHC-UHFFFAOYSA-N
Mol Weight 570.61 g/mol
Molecular Formula C30H30N6O6
Exact Mass 570.222683 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L84Nh0A3Kaz
Name 4,4',4''-(1,3,5-TRIAZINE-2,4,6-TRIYLTRIIMINO)-TRIS-BENZOIC-ACID-1,1',1''-TRIETHYLESTER
CAS Registry Number 96474-94-1
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H30N6O6
InChI InChI=1S/C30H30N6O6/c1-4-40-25(37)19-7-13-22(14-8-19)31-28-34-29(32-23-15-9-20(10-16-23)26(38)41-5-2)36-30(35-28)33-24-17-11-21(12-18-24)27(39)42-6-3/h7-18H,4-6H2,1-3H3,(H3,31,32,33,34,35,36)
InChIKey UHGOHGRPESTFHC-UHFFFAOYSA-N
Literature Reference Author N.MIBU,K.YOKOMIZO,S.TAKEMURA,N.UEKI,S.ITOHARA,J.ZHOU,T.MIYAT A,K.SUMOTO
Literature Reference Citation CHEM.PHARM.BULL.,61,823(2013)
Literature Reference DOI 10.1248/cpb.c13-00308
Molecular Weight 570.605 g/mol
Source File Reference UWIR4101