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9,10-DIHYDROKERAMADINE
SpectraBase Compound ID 8VW1BjCh9gs
InChI InChI=1S/C12H16BrN5O/c1-18-9(7-17-12(18)14)3-2-4-15-11(19)10-5-8(13)6-16-10/h5-7,16H,2-4H2,1H3,(H2,14,17)(H,15,19)
InChIKey CIJYGXMFPDRTAS-UHFFFAOYSA-N
Mol Weight 326.2 g/mol
Molecular Formula C12H16BrN5O
Exact Mass 325.053823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ZlETJo41Yo
Name 9,10-DIHYDROKERAMADINE
CAS Registry Number 690243-42-6
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16BrN5O
InChI InChI=1S/C12H16BrN5O/c1-18-9(7-17-12(18)14)3-2-4-15-11(19)10-5-8(13)6-16-10/h5-7,16H,2-4H2,1H3,(H2,14,17)(H,15,19)
InChIKey CIJYGXMFPDRTAS-UHFFFAOYSA-N
Literature Reference Author T.ENDO,M.TSUDA,T.OKADA,S.MITSUHASHI,H.SHIMA,K.KIKUCHI,Y.MIKA MI,J.FROMONT,J.I.KOB
Literature Reference Citation J.NAT.PROD.,67,1262(2004)
Literature Reference DOI 10.1021/np034077n
Molecular Weight 326.196 g/mol
Solvent DMSO-D6
Source File Reference UWMZ7304