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2-(CHOLESTERYL-3-O-)-1,3-BUTYLENETHIOPHOSPHATE
SpectraBase Compound ID ELeKWKg01we
InChI InChI=1S/C31H53O3PS/c1-21(2)8-7-9-22(3)27-12-13-28-26-11-10-24-20-25(34-35(36)32-19-16-23(4)33-35)14-17-30(24,5)29(26)15-18-31(27,28)6/h10,21-23,25-29H,7-9,11-20H2,1-6H3/t22?,23?,25?,26?,27?,28?,29?,30-,31+,35?/m1/s1
InChIKey UJXBKCDHYWDJQX-NUMPXTJPSA-N
Mol Weight 536.8 g/mol
Molecular Formula C31H53O3PS
Exact Mass 536.345304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQoBL9hmCAI
Name 2-(CHOLESTERYL-3-O-)-1,3-BUTYLENETHIOPHOSPHATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H53O3PS
InChI InChI=1S/C31H53O3PS/c1-21(2)8-7-9-22(3)27-12-13-28-26-11-10-24-20-25(34-35(36)32-19-16-23(4)33-35)14-17-30(24,5)29(26)15-18-31(27,28)6/h10,21-23,25-29H,7-9,11-20H2,1-6H3/t22?,23?,25?,26?,27?,28?,29?,30-,31+,35?/m1/s1
InChIKey UJXBKCDHYWDJQX-NUMPXTJPSA-N
Instrument Name Bruker AM-400
Literature Reference S.D.STAMATOV, S.A.IVANOV (1989) Phosphorus and Sulfur: v.45, N1, 73-79.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6D6 benzene-d6