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5-CHLOROACREMINE_A

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5-CHLOROACREMINE_A
SpectraBase Compound ID 4eZ0X51c7Qc
InChI InChI=1S/C12H17ClO4/c1-11(2,16)5-4-7-6-8(14)12(3,17)10(13)9(7)15/h4-6,9-10,15-17H,1-3H3/b5-4+/t9-,10+,12+/m1/s1
InChIKey BEHCJZAKUQKRSB-QTIKQWDBSA-N
Mol Weight 260.72 g/mol
Molecular Formula C12H17ClO4
Exact Mass 260.081537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiwvLiX6sHL
Name 5-CHLOROACREMINE_A
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17ClO4
InChI InChI=1S/C12H17ClO4/c1-11(2,16)5-4-7-6-8(14)12(3,17)10(13)9(7)15/h4-6,9-10,15-17H,1-3H3/b5-4+/t9-,10+,12+/m1/s1
InChIKey BEHCJZAKUQKRSB-QTIKQWDBSA-N
Literature Reference Author X.SUCIATI,J.A.FRASER,L.K.LAMBERT,G.K.PIERENS,P.V.BERNHARDT,M .J.GARSON
Literature Reference Citation J.NAT.PROD.,76,1432(2013)
Literature Reference DOI 10.1021/np4002114
Molecular Weight 260.718 g/mol
Solvent CDCl3
Source File Reference UWMZ43016