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3,5,7-Triaza-12-(1-trichloroacetoxy-ethyl)-10,11,12-trimethyl-5-phenyl-tricyclo(7.3.0.0/3,5/)dodeca-1(6),7-diene
SpectraBase Compound ID Hf2iWNQVxXJ
InChI InChI=1S/C22H22Cl3N3O4/c1-12-13(2)21(4,14(3)32-18(29)22(23,24)25)17-11-27-20(31)28(15-8-6-5-7-9-15)19(30)26(27)10-16(12)17/h5-9,14H,10-11H2,1-4H3
InChIKey GEHHJHQEBRWOMY-UHFFFAOYSA-N
Mol Weight 498.79 g/mol
Molecular Formula C22H22Cl3N3O4
Exact Mass 497.067589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A8cu8FmHLD0
Name 3,5,7-Triaza-12-(1-trichloroacetoxy-ethyl)-10,11,12-trimethyl-5-phenyl-tricyclo(7.3.0.0/3,5/)dodeca-1(6),7-diene
CAS Registry Number 64686-24-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H22Cl3N3O4
InChI InChI=1S/C22H22Cl3N3O4/c1-12-13(2)21(4,14(3)32-18(29)22(23,24)25)17-11-27-20(31)28(15-8-6-5-7-9-15)19(30)26(27)10-16(12)17/h5-9,14H,10-11H2,1-4H3
InChIKey GEHHJHQEBRWOMY-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference H. Hogeveen, W.F. Huurdeman, J. Am. Chem. Soc. 100, 860 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3