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(E)-4-tosylhepta-3,6-dien-2-one dimethyl ketal
SpectraBase Compound ID 8ZwsZW9vALN
InChI InChI=1S/C16H22O4S/c1-6-7-15(12-16(3,19-4)20-5)21(17,18)14-10-8-13(2)9-11-14/h6,8-12H,1,7H2,2-5H3/b15-12+
InChIKey AMQAOKVSWCWZBV-NTCAYCPXSA-N
Mol Weight 310.41 g/mol
Molecular Formula C16H22O4S
Exact Mass 310.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cc0YomDD2Xq
Name (E)-4-tosylhepta-3,6-dien-2-one dimethyl ketal
Alternate Name(s) (1E)-1-allyl-3,3-dimethoxy-1-butenyl 4-methylphenyl sulfone 1-{[(1E)-1-allyl-3,3-dimethoxy-1-butenyl]sulfonyl}-4-methylbenzene
CAS Registry Number 115562-95-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4S
InChI InChI=1S/C16H22O4S/c1-6-7-15(12-16(3,19-4)20-5)21(17,18)14-10-8-13(2)9-11-14/h6,8-12H,1,7H2,2-5H3/b15-12+
InChIKey AMQAOKVSWCWZBV-NTCAYCPXSA-N
Molecular Weight 310.408 g/mol
SMILES C(\C=C/(S(c1ccc(cc1)C)(=O)=O)CC=C)(OC)(OC)C
SPLASH splash10-00du-6900000000-f4082bd997df89229763
Source of Spectrum J-53-4712-16
Wiley ID 1311385