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4-(methylthio)-N-hexadecylaniline
SpectraBase Compound ID IXlKtgWHONN
InChI InChI=1S/C23H41NS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24-22-17-19-23(25-2)20-18-22/h17-20,24H,3-16,21H2,1-2H3
InChIKey KOTBWSMEPUYYHI-UHFFFAOYSA-N
Mol Weight 363.6 g/mol
Molecular Formula C23H41NS
Exact Mass 363.295971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FyBY2MqHY
Name 4-(methylthio)-N-hexadecylaniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.295971498 u
Formula C23H41NS
GC Column HP-5 (30 m x 250 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C23H41NS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24-22-17-19-23(25-2)20-18-22/h17-20,24H,3-16,21H2,1-2H3
InChIKey KOTBWSMEPUYYHI-UHFFFAOYSA-N
Instrument Name Agilent 5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.201603681
Molecular Weight 363.648 g/mol
Quality 77
Reported Formula C23H41NS
SMILES N(C1=CC=C(SC)C=C1)CCCCCCCCCCCCCCCC
SPLASH splash10-0ik9-0829000000-60e5c053ff3353ed122c
Source of Spectrum ACI-55-SM20-20-2 (DOI: 10.1002/anie.201603681)
Wiley ID 1899157