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OTONECINE-HYDROCHLORIDE,ISOMER-#1
SpectraBase Compound ID HIGZkf9FUaw
InChI InChI=1S/C9H16NO3.ClH/c1-10-4-2-7(6-11)9(10,13)8(12)3-5-10;/h2,8,11-13H,3-6H2,1H3;1H/q+1;/p-1/t8-,9+,10?;/m1./s1
InChIKey OOKWCHLTNRMNCY-PKPBJMGWSA-M
Mol Weight 221.68 g/mol
Molecular Formula C9H16ClNO3
Exact Mass 221.081871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EjlnnUIibMA
Name OTONECINE-HYDROCHLORIDE,ISOMER-#1
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16ClNO3
InChI InChI=1S/C9H16NO3.ClH/c1-10-4-2-7(6-11)9(10,13)8(12)3-5-10;/h2,8,11-13H,3-6H2,1H3;1H/q+1;/p-1/t8-,9+,10?;/m1./s1
InChIKey OOKWCHLTNRMNCY-PKPBJMGWSA-M
Literature Reference Author E.ROEDER,K.LIU,T.BOURAUEL
Literature Reference Citation FRES.J.ANAL.CHEM.,342,719(1992)
Literature Reference DOI 10.1007/bf00321863
Molecular Weight 221.684 g/mol
Solvent D2O
Source File Reference UWCS9716