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[1-13C,160180]-SODIUM-HEXANOATE

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[1-13C,160180]-SODIUM-HEXANOATE
SpectraBase Compound ID IK14voPiJ7k
InChI InChI=1S/C6H12O2.Na/c1-2-3-4-5-6(7)8;/h2-5H2,1H3,(H,7,8);/q;+1/p-1/i6+1,7+2;
InChIKey UDWXLZLRRVQONG-RWCKRATESA-M
Mol Weight 141.13 g/mol
Molecular Formula C513CH11NaO18O
Exact Mass 141.073274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3Kbz1IGL4g
Name [1-13C,160180]-SODIUM-HEXANOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C513CH11NaO18O
InChI InChI=1S/C6H12O2.Na/c1-2-3-4-5-6(7)8;/h2-5H2,1H3,(H,7,8);/q;+1/p-1/i6+1,7+2;
InChIKey UDWXLZLRRVQONG-RWCKRATESA-M
Literature Reference Author S.W.BROBST,C.A.TOWNSEND
Literature Reference Citation CAN.J.CHEM.,72,200(1994)
Literature Reference DOI 10.1139/v94-031
Molecular Weight 141.134 g/mol
Solvent D2O
Source File Reference UWPR1087