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2-BROMO-9,10-DIHYDRO-KERAMADINE
SpectraBase Compound ID 3DwqwdqUVz4
InChI InChI=1S/C12H15Br2N5O/c1-19-7(6-17-12(19)15)3-2-4-16-11(20)9-5-8(13)10(14)18-9/h5-6,18H,2-4H2,1H3,(H2,15,17)(H,16,20)
InChIKey LJSJUMQRDYCKAB-UHFFFAOYSA-N
Mol Weight 405.09 g/mol
Molecular Formula C12H15Br2N5O
Exact Mass 402.964336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4iQBrQZj1Br
Name 2-BROMO-9,10-DIHYDRO-KERAMADINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15Br2N5O
InChI InChI=1S/C12H15Br2N5O/c1-19-7(6-17-12(19)15)3-2-4-16-11(20)9-5-8(13)10(14)18-9/h5-6,18H,2-4H2,1H3,(H2,15,17)(H,16,20)
InChIKey LJSJUMQRDYCKAB-UHFFFAOYSA-N
Literature Reference Author T.KUSAMA,N.TANAKA,A.TAKAHASHI-NAKAGUCHI,T.GONOI,J.FROMONT,J. KOBAYASHI
Literature Reference Citation CHEM.PHARM.BULL.,62,499(2014)
Literature Reference DOI 10.1248/cpb.c14-00077
Molecular Weight 405.092 g/mol
Solvent DMSO-D6
Source File Reference UWBT13901