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5-CHLOROBOHEMAMINE_C

View entire compound with spectra: 1 NMR

5-CHLOROBOHEMAMINE_C
SpectraBase Compound ID 41Swfj5ar7e
InChI InChI=1S/C14H19ClN2O3/c1-7(2)5-11(19)16-10-6-9(18)14(4)13(20)12(15)8(3)17(10)14/h5-6,8,12-13,20H,1-4H3,(H,16,19)/t8-,12-,13+,14+/m1/s1
InChIKey XSOZVHIZNODJTJ-NGSVMEPUSA-N
Mol Weight 298.77 g/mol
Molecular Formula C14H19ClN2O3
Exact Mass 298.10842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L2a4vyF2jfy
Name 5-CHLOROBOHEMAMINE_C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H19ClN2O3
InChI InChI=1S/C14H19ClN2O3/c1-7(2)5-11(19)16-10-6-9(18)14(4)13(20)12(15)8(3)17(10)14/h5-6,8,12-13,20H,1-4H3,(H,16,19)/t8-,12-,13+,14+/m1/s1
InChIKey XSOZVHIZNODJTJ-NGSVMEPUSA-N
Literature Reference Author T.S.BUGNI,M.WOOLERY,C.A.KAUFFMAN,P.R.JENSEN,W.FENICAL
Literature Reference Citation J.NAT.PROD.,69,1626(2006)
Literature Reference DOI 10.1021/np0602721
Molecular Weight 298.769 g/mol
Solvent DMSO-D6
Source File Reference UWMZ17221