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(S)-D-3-CHLORO-1,2-PROPANEDIOL-1-PHOSPHATE-DIAMMONIUM-SALT

View entire compound with spectra: 2 NMR

(S)-D-3-CHLORO-1,2-PROPANEDIOL-1-PHOSPHATE-DIAMMONIUM-SALT
SpectraBase Compound ID 1JoW0HITsHK
InChI InChI=1S/C3H8ClO5P.2N/c4-1-3(5)2-9-10(6,7)8;;/h3,5H,1-2H2,(H2,6,7,8);;/q;2*+1/p-2/t3-;;/m0../s1
InChIKey QOCHSLBXYWBJQL-QTNFYWBSSA-L
Mol Weight 216.517 g/mol
Molecular Formula C3H6ClN2O5P
Exact Mass 215.970286 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3IQFqyoW813
Name (S)-D-3-CHLORO-1,2-PROPANEDIOL-1-PHOSPHATE-DIAMMONIUM-SALT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H6ClN2O5P
InChI InChI=1S/C3H8ClO5P.2N/c4-1-3(5)2-9-10(6,7)8;;/h3,5H,1-2H2,(H2,6,7,8);;/q;2*+1/p-2/t3-;;/m0../s1
InChIKey QOCHSLBXYWBJQL-QTNFYWBSSA-L
Literature Reference Author H.K.CHENAULT,L.F.CHAFIN,S.LIEHR
Literature Reference Citation J.ORG.CHEM.,63,4039(1998)
Literature Reference DOI 10.1021/jo980122y
Molecular Weight 216.518 g/mol
Sample ID 28450
Solvent D2O