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3,3'-Thiodipropionic acid, dioctadecyl ester

View entire compound with spectra: 5 NMR, 12 FTIR, 2 Raman, and 1 MS (GC)

3,3'-Thiodipropionic acid, dioctadecyl ester
SpectraBase Compound ID 9xl7FNjt9DF
InChI InChI=1S/C42H82O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-45-41(43)35-39-47-40-36-42(44)46-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3
InChIKey PWWSSIYVTQUJQQ-UHFFFAOYSA-N
Mol Weight 683.2 g/mol
Molecular Formula C42H82O4S
Exact Mass 682.593382 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 33XnnkXG7xY
Name 3,3'-Thiodipropionic acid, dioctadecyl ester
CAS Registry Number 693-36-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C42H82O4S
InChI InChI=1S/C42H82O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-45-41(43)35-39-47-40-36-42(44)46-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3
InChIKey PWWSSIYVTQUJQQ-UHFFFAOYSA-N
Instrument Name Varian HA-100
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3