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17,18-bis(Methylthio)-pentacosanal

View entire compound with spectra: 1 MS (GC)

17,18-bis(Methylthio)-pentacosanal
SpectraBase Compound ID EEpPK582IeG
InChI InChI=1S/C27H54OS2/c1-4-5-6-17-20-23-26(29-2)27(30-3)24-21-18-15-13-11-9-7-8-10-12-14-16-19-22-25-28/h25-27H,4-24H2,1-3H3
InChIKey FELLZYIMRLDEHC-UHFFFAOYSA-N
Mol Weight 458.8 g/mol
Molecular Formula C27H54OS2
Exact Mass 458.361609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVOO57KWlzR
Name 17,18-bis(Methylthio)-pentacosanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H54OS2
InChI InChI=1S/C27H54OS2/c1-4-5-6-17-20-23-26(29-2)27(30-3)24-21-18-15-13-11-9-7-8-10-12-14-16-19-22-25-28/h25-27H,4-24H2,1-3H3
InChIKey FELLZYIMRLDEHC-UHFFFAOYSA-N
Molecular Weight 458.848 g/mol
SMILES C(CCCCCCCCCCCCCCCC(C(CCCCCCC)SC)SC)=O
SPLASH splash10-05mk-6970000000-6d1b19654385f891033f
Source of Spectrum X2-56-745-0
Synonyms 17,18-Bis(methylsulfanyl)pentacosanal
Wiley ID 1604850