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QRCHFTPWKYEDNH-CJNGLKHVSA-N

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QRCHFTPWKYEDNH-CJNGLKHVSA-N
SpectraBase Compound ID BuRk4ryBH5l
InChI InChI=1S/C16H19Br2N3O7/c1-26-12-9(17)5-16(13(23)11(12)18)6-10(21-28-16)14(24)19-4-3-8(22)7-20-15(25)27-2/h5,13,23H,3-4,6-7H2,1-2H3,(H,19,24)(H,20,25)/t13-,16+/m1/s1
InChIKey QRCHFTPWKYEDNH-CJNGLKHVSA-N
Mol Weight 525.15 g/mol
Molecular Formula C16H19Br2N3O7
Exact Mass 522.958976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HY5UaxJAm17
Name QRCHFTPWKYEDNH-CJNGLKHVSA-N
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19Br2N3O7
InChI InChI=1S/C16H19Br2N3O7/c1-26-12-9(17)5-16(13(23)11(12)18)6-10(21-28-16)14(24)19-4-3-8(22)7-20-15(25)27-2/h5,13,23H,3-4,6-7H2,1-2H3,(H,19,24)(H,20,25)/t13-,16+/m1/s1
InChIKey QRCHFTPWKYEDNH-CJNGLKHVSA-N
Literature Reference Author P.CIMINIELLO,C.DELLAVERSANO,E.FATTORUSSO,S.MAGNO,M.PANSINI
Literature Reference Citation J.NAT.PROD.,62,590(1999)
Literature Reference DOI 10.1021/np9805138
Molecular Weight 525.151 g/mol
Solvent DMSO-D6
Source File Reference UWGE1052