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N-Phenyl-4-[2-((E)-prop-2-en-1-yl)-1,3-dithian-2-yl]-butyramide
SpectraBase Compound ID 5oPWElhu8l0
InChI InChI=1S/C17H23NOS2/c1-2-11-17(20-13-7-14-21-17)12-6-10-16(19)18-15-8-4-3-5-9-15/h2-5,8-9H,1,6-7,10-14H2,(H,18,19)
InChIKey PTMXDICBVVALJL-UHFFFAOYSA-N
Mol Weight 321.5 g/mol
Molecular Formula C17H23NOS2
Exact Mass 321.122107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJi7Svqbjc5
Name N-Phenyl-4-[2-((E)-prop-2-en-1-yl)-1,3-dithian-2-yl]-butyramide
Alternate Name(s) 4-(2-allyl-1,3-dithian-2-yl)-N-phenylbutanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NOS2
InChI InChI=1S/C17H23NOS2/c1-2-11-17(20-13-7-14-21-17)12-6-10-16(19)18-15-8-4-3-5-9-15/h2-5,8-9H,1,6-7,10-14H2,(H,18,19)
InChIKey PTMXDICBVVALJL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201100455
Molecular Weight 321.497 g/mol
SMILES N(C(CCCC1(SCCCS1)CC=C)=O)c1ccccc1
SPLASH splash10-00kf-9052000000-8a04409ebfbad580029d
Source of Spectrum APC-345-661-6b
Wiley ID 1769410