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(E)-2-methyl-3-tosyl-2,5-hexadienal
SpectraBase Compound ID E13gfhrWC5v
InChI InChI=1S/C14H16O3S/c1-4-5-14(12(3)10-15)18(16,17)13-8-6-11(2)7-9-13/h4,6-10H,1,5H2,2-3H3/b14-12+
InChIKey RDHKQJSHLDFXIP-WYMLVPIESA-N
Mol Weight 264.34 g/mol
Molecular Formula C14H16O3S
Exact Mass 264.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 75Ixu126ArE
Name (E)-2-methyl-3-tosyl-2,5-hexadienal
Alternate Name(s) (2E)-2-methyl-3-[(4-methylphenyl)sulfonyl]-2,5-hexadienal
CAS Registry Number 118356-37-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3S
InChI InChI=1S/C14H16O3S/c1-4-5-14(12(3)10-15)18(16,17)13-8-6-11(2)7-9-13/h4,6-10H,1,5H2,2-3H3/b14-12+
InChIKey RDHKQJSHLDFXIP-WYMLVPIESA-N
Molecular Weight 264.339 g/mol
SMILES C(\C(=C/(S(c1ccc(cc1)C)(=O)=O)CC=C)C)=O
SPLASH splash10-000f-9100000000-cb599c12e16bd13bc2a5
Source of Spectrum J-54-1498-12
Wiley ID 1267751