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8-CHLORO-4,10-DIMETHYL-4H-1,3,4-OXADIAZINO-[5,6-B]-QUINOXALIN-10-IUM-2-(N-BUTOXYCARBONYL)-AMIDATE
SpectraBase Compound ID Ec19BFGV3Dm
InChI InChI=1S/C16H18ClN5O3/c1-4-5-8-24-16(23)19-15-20-22(3)13-14(25-15)21(2)12-9-10(17)6-7-11(12)18-13/h6-7,9H,4-5,8H2,1-3H3
InChIKey QCECRXUJNULXIY-UHFFFAOYSA-N
Mol Weight 363.81 g/mol
Molecular Formula C16H18ClN5O3
Exact Mass 363.109817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74Dq6NgShcD
Name 8-CHLORO-4,10-DIMETHYL-4H-1,3,4-OXADIAZINO-[5,6-B]-QUINOXALIN-10-IUM-2-(N-BUTOXYCARBONYL)-AMIDATE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18ClN5O3
InChI InChI=1S/C16H18ClN5O3/c1-4-5-8-24-16(23)19-15-20-22(3)13-14(25-15)21(2)12-9-10(17)6-7-11(12)18-13/h6-7,9H,4-5,8H2,1-3H3
InChIKey QCECRXUJNULXIY-UHFFFAOYSA-N
Literature Reference Author Y.KURASAWA,T.MITOMI,Y.OKAMOTO,H.S.KIM
Literature Reference Citation J.HETCYCL.CHEM.,35,1333(1998)
Literature Reference DOI 10.1002/jhet.5570350617
Molecular Weight 363.804 g/mol
Solvent TFA-D1