For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(MES(CH2)4P(O)(ONA)2)-7-(ME2S)B12H10

View entire compound with spectra: 2 NMR

1-(MES(CH2)4P(O)(ONA)2)-7-(ME2S)B12H10
SpectraBase Compound ID 9qs20E7kMh1
InChI InChI=1S/C7H19B12O3PS2.2Na/c1-24(2)18-11-8-10-9(11)13(10)14(9,11)16(11,18)17(18)12(8,10,18)15(10,13,17)19(13,14,16,17)25(3)7-5-4-6-23(20,21)22;;/h4-7H2,1-3H3,(H2,20,21,22);;/q;2*+1/p-2
InChIKey GIYMFRNPCZJMIL-UHFFFAOYSA-L
Mol Weight 420.00330056 g/mol
Molecular Formula C7H17B12Na2O3PS2
Exact Mass 422.126874 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5FL2mOrWTMr
Name 1-(MES(CH2)4P(O)(ONA)2)-7-(ME2S)B12H10
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H17B12Na2O3PS2
InChI InChI=1S/C7H19B12O3PS2.2Na/c1-24(2)18-11-8-10-9(11)13(10)14(9,11)16(11,18)17(18)12(8,10,18)15(10,13,17)19(13,14,16,17)25(3)7-5-4-6-23(20,21)22;;/h4-7H2,1-3H3,(H2,20,21,22);;/q;2*+1/p-2
InChIKey GIYMFRNPCZJMIL-UHFFFAOYSA-L
Literature Reference Author R.G.KULTYSHEV,J.LIU,S.LIU,W.TJARKS,A.H.SOLOWAY,S.G.SHORE
Literature Reference Citation J.AM.CHEM.SOC.,124,2614(2002)
Literature Reference DOI 10.1021/ja0123857
Molecular Weight 420.003 g/mol
Sample ID 48593
Solvent CD3OD