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XKIPHALWBXPCCM-UHFFFAOYSA-N

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XKIPHALWBXPCCM-UHFFFAOYSA-N
SpectraBase Compound ID 2DyfXZ1Cp5J
InChI InChI=1S/C10H13N3.ClHO4/c1-13(2)12-9-8-11-10-6-4-3-5-7-10;2-1(3,4)5/h3-9H,1-2H3;(H,2,3,4,5)
InChIKey XKIPHALWBXPCCM-UHFFFAOYSA-N
Mol Weight 275.69 g/mol
Molecular Formula C10H14ClN3O4
Exact Mass 275.067284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AFn2St4EpB2
Name 1,1-DIMETHYL-5-PHENYL-1,2,5-TRIAZAPENTADIENIUM-PERCHLORATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14ClN3O4
InChI InChI=1S/C10H13N3.ClHO4/c1-13(2)12-9-8-11-10-6-4-3-5-7-10;2-1(3,4)5/h3-9H,1-2H3;(H,2,3,4,5)
InChIKey XKIPHALWBXPCCM-UHFFFAOYSA-N
Literature Reference Author A.J.JONES,H.MCNAB,P.HANISCH
Literature Reference Citation AUSTR.J.CHEM.,31,1005(1978)
Literature Reference DOI 10.1071/ch9781005
Molecular Weight 275.692 g/mol
Solvent DMSO-D6
Source File Reference UWCS5398