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1-OCTADECYLTHIO-3-TRITYLOXY-2-PROPANOL ACETATE

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1-OCTADECYLTHIO-3-TRITYLOXY-2-PROPANOL ACETATE
SpectraBase Compound ID 40yPiGvBJL3
InChI InChI=1S/C42H60O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-34-46-36-41(45-37(2)43)35-44-42(38-28-21-18-22-29-38,39-30-23-19-24-31-39)40-32-25-20-26-33-40/h18-26,28-33,41H,3-17,27,34-36H2,1-2H3
InChIKey CSQSQKGEVACTCH-UHFFFAOYSA-N
Mol Weight 645.0 g/mol
Molecular Formula C42H60O3S
Exact Mass 644.426317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYaMRsWOAEN
Name 1-OCTADECYLTHIO-3-TRITYLOXY-2-PROPANOL ACETATE
Comments XY
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C42H60O3S
InChI InChI=1S/C42H60O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-34-46-36-41(45-37(2)43)35-44-42(38-28-21-18-22-29-38,39-30-23-19-24-31-39)40-32-25-20-26-33-40/h18-26,28-33,41H,3-17,27,34-36H2,1-2H3
InChIKey CSQSQKGEVACTCH-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference B.GARRIGUES, G.BERTRAND, D.FREHEL, J.P.MAFFRAND (1984) Phosphorus and Sulfur:v.21, N2, 171-176.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C5D5N pyridine-d5