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YECBQYCMWZOBFV-RXOVGKCDSA-M

View entire compound with spectra: 1 NMR

YECBQYCMWZOBFV-RXOVGKCDSA-M
SpectraBase Compound ID 7HQQnflrcLG
InChI InChI=1S/C12H13F3N4O6/c13-12(14,15)7-10-19(1-3(21)6(25-10)4(22)2-20)8-5(16-7)9(23)18-11(24)17-8/h3-4,6,10,20-22H,1-2H2,(H2,17,18,23,24)/p-1/t3-,4+,6-,10?/m0/s1
InChIKey YECBQYCMWZOBFV-RXOVGKCDSA-M
Mol Weight 365.25 g/mol
Molecular Formula C12H12F3N4O6
Exact Mass 365.070894 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QH2MJXHhQ6
Name YECBQYCMWZOBFV-RXOVGKCDSA-M
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12F3N4O6
InChI InChI=1S/C12H13F3N4O6/c13-12(14,15)7-10-19(1-3(21)6(25-10)4(22)2-20)8-5(16-7)9(23)18-11(24)17-8/h3-4,6,10,20-22H,1-2H2,(H2,17,18,23,24)/p-1/t3-,4+,6-,10?/m0/s1
InChIKey YECBQYCMWZOBFV-RXOVGKCDSA-M
Literature Reference Author M.CUSHMAN,H.H.PATEL,J.SCHEURING,A.BACHER
Literature Reference Citation J.ORG.CHEM.,58,4033(1993)
Literature Reference DOI 10.1021/jo00067a041
Molecular Weight 365.246 g/mol
Solvent H2O-PHOSPHATE-BUFFER;PH=7
Source File Reference UWRU968