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RDRPWFCBCJCQHM-QYKYNADBSA-N
SpectraBase Compound ID DtRF541rFBx
InChI InChI=1S/C22H29N3.ClHO4/c23-16-22(19-7-2-1-3-8-19)11-6-10-21-17-13-18(15-25(21)22)20-9-4-5-12-24(20)14-17;2-1(3,4)5/h1-3,7-8,17-18,20-21H,4-6,9-15H2;(H,2,3,4,5)/t17-,18-,20-,21+,22?;/m0./s1
InChIKey RDRPWFCBCJCQHM-QYKYNADBSA-N
Mol Weight 435.95 g/mol
Molecular Formula C22H30ClN3O4
Exact Mass 435.192484 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7cZ2DEQxDS9
Name RDRPWFCBCJCQHM-QYKYNADBSA-N
Compound Number (A-20).CLO4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30ClN3O4
InChI InChI=1S/C22H29N3.ClHO4/c23-16-22(19-7-2-1-3-8-19)11-6-10-21-17-13-18(15-25(21)22)20-9-4-5-12-24(20)14-17;2-1(3,4)5/h1-3,7-8,17-18,20-21H,4-6,9-15H2;(H,2,3,4,5)/t17-,18-,20-,21+,22?;/m0./s1
InChIKey RDRPWFCBCJCQHM-QYKYNADBSA-N
Literature Reference Author B.MIKHOVA,H.DUDDECK
Literature Reference Citation MAGN.RES.CHEM.,36,779(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(1998110)36:11<779::aid-omr374>3.3.co;2-r
Molecular Weight 435.951 g/mol
Solvent CD3CN