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HFMVANDZRWDINR-UHFFFAOYSA-N

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HFMVANDZRWDINR-UHFFFAOYSA-N
SpectraBase Compound ID 3X7KmAIQ4aT
InChI InChI=1S/C13H20BrNO3/c1-2-7-18-13(17)11-5-3-10(4-6-11)9-15-12(16)8-14/h2,10-11H,1,3-9H2,(H,15,16)
InChIKey HFMVANDZRWDINR-UHFFFAOYSA-N
Mol Weight 318.21 g/mol
Molecular Formula C13H20BrNO3
Exact Mass 317.062657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JkHx6yGJQSY
Name HFMVANDZRWDINR-UHFFFAOYSA-N
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20BrNO3
InChI InChI=1S/C13H20BrNO3/c1-2-7-18-13(17)11-5-3-10(4-6-11)9-15-12(16)8-14/h2,10-11H,1,3-9H2,(H,15,16)
InChIKey HFMVANDZRWDINR-UHFFFAOYSA-N
Literature Reference Author S.GU,H.K.KIM,G.H.LEE,B.S.KANG,Y.CHANG,T.J.KIM
Literature Reference Citation J.MED.CHEM.,54,143(2011)
Literature Reference DOI 10.1021/jm100966t
Molecular Weight 318.211 g/mol
Solvent DMSO-D6
Source File Reference UWMZ47129