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Dodecyl(3-phenyl propyl)sulfane
SpectraBase Compound ID 4aZyPbbeA63
InChI InChI=1S/C21H36S/c1-2-3-4-5-6-7-8-9-10-14-19-22-20-15-18-21-16-12-11-13-17-21/h11-13,16-17H,2-10,14-15,18-20H2,1H3
InChIKey KQZJNINOXUOOMN-UHFFFAOYSA-N
Mol Weight 320.6 g/mol
Molecular Formula C21H36S
Exact Mass 320.253772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aw4AP22sZaw
Name Dodecyl(3-phenyl propyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.253772333 u
Formula C21H36S
InChI InChI=1S/C21H36S/c1-2-3-4-5-6-7-8-9-10-14-19-22-20-15-18-21-16-12-11-13-17-21/h11-13,16-17H,2-10,14-15,18-20H2,1H3
InChIKey KQZJNINOXUOOMN-UHFFFAOYSA-N
Instrument Name Thermo DSQII
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701692
Molecular Weight 320.579 g/mol
Quality 60
SMILES C(CCCCCCCCCCC)SCCCC1=CC=CC=C1
SPLASH splash10-014i-1900000000-d620607f698de338fe08
Source of Spectrum K1-2018-733-3d (DOI: 10.1002/ejoc.201701692)
Wiley ID 1894440