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(2,3-13C2)-3-KETOHEXANOIC-ACID-N-ACETYLCYSTEAMINEESTER
SpectraBase Compound ID 9WWSQhzEQKO
InChI InChI=1S/C10H17NO3S/c1-3-4-9(13)7-10(14)15-6-5-11-8(2)12/h3-7H2,1-2H3,(H,11,12)/i7+1,9+1
InChIKey FHAYDILUIHHYDE-VEJAREIZSA-N
Mol Weight 233.29 g/mol
Molecular Formula C813C2H17NO3S
Exact Mass 233.099624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID gYsTVtvhDF
Name (2,3-13C2)-3-KETOHEXANOIC-ACID-N-ACETYLCYSTEAMINEESTER
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H17NO3S
InChI InChI=1S/C10H17NO3S/c1-3-4-9(13)7-10(14)15-6-5-11-8(2)12/h3-7H2,1-2H3,(H,11,12)/i7+1,9+1
InChIKey FHAYDILUIHHYDE-VEJAREIZSA-N
Literature Reference Author R.J.PARRY,S.V.MHASKAR,M.T.LIN,A.E.WALKER,R.MAFOTI
Literature Reference Citation CAN.J.CHEM.,72,86(1994)
Literature Reference DOI 10.1139/v94-014
Molecular Weight 231.310 g/mol
Solvent CDCl3
Source File Reference UWPR331