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3,3'-Thiodipropionic acid, didodecyl ester
SpectraBase Compound ID 7HkEO4r82MU
InChI InChI=1S/C30H58O4S/c1-3-5-7-9-11-13-15-17-19-21-25-33-29(31)23-27-35-28-24-30(32)34-26-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
InChIKey GHKOFFNLGXMVNJ-UHFFFAOYSA-N
Mol Weight 514.9 g/mol
Molecular Formula C30H58O4S
Exact Mass 514.405582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kEl8anZZSN
Name Dilaurylthiodipropionate
CAS Registry Number 123-28-4
Classification Antioxidant
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 514.405581518 u
Formula C30H58O4S
InChI InChI=1S/C30H58O4S/c1-3-5-7-9-11-13-15-17-19-21-25-33-29(31)23-27-35-28-24-30(32)34-26-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
InChIKey GHKOFFNLGXMVNJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 514.850 g/mol
SMILES CCCCCCCCCCCCOC(CCSCCC(=O)OCCCCCCCCCCCC)=O
SPLASH splash10-0a4i-9501000000-885be4b95668b632d7b9
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3532