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IXJNMRHRZIENJG-MRHIQRDNSA-N

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IXJNMRHRZIENJG-MRHIQRDNSA-N
SpectraBase Compound ID KWGIycrOcRf
InChI InChI=1S/C17H17N5O4/c18-15-14-16(20-8-19-15)22(9-21-14)13-6-11-12(25-13)7-24-17(23,26-11)10-4-2-1-3-5-10/h1-5,8-9,11-13,23H,6-7H2,(H2,18,19,20)/t11-,12-,13-,17-/m0/s1
InChIKey IXJNMRHRZIENJG-MRHIQRDNSA-N
Mol Weight 355.35 g/mol
Molecular Formula C17H17N5O4
Exact Mass 355.128054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID kECZZ0omav
Name IXJNMRHRZIENJG-MRHIQRDNSA-N
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N5O4
InChI InChI=1S/C17H17N5O4/c18-15-14-16(20-8-19-15)22(9-21-14)13-6-11-12(25-13)7-24-17(23,26-11)10-4-2-1-3-5-10/h1-5,8-9,11-13,23H,6-7H2,(H2,18,19,20)/t11-,12-,13-,17-/m0/s1
InChIKey IXJNMRHRZIENJG-MRHIQRDNSA-N
Literature Reference Author F.SEELA,K.WOERNER,H.ROSEMEYER
Literature Reference Citation HELV.CHIM.ACTA,77,883(1994)
Literature Reference DOI 10.1002/hlca.19940770328
Molecular Weight 355.353 g/mol
Solvent DMSO-D6
Source File Reference UWPR1757