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(E)-3-Ethoxymethoxy-1-(phenylsulfonyl)oct-1-en-6-yne
SpectraBase Compound ID 2gHFJsnNboS
InChI InChI=1S/C17H22O4S/c1-3-5-7-10-16(21-15-20-4-2)13-14-22(18,19)17-11-8-6-9-12-17/h6,8-9,11-14,16H,4,7,10,15H2,1-2H3/b14-13+
InChIKey ZQXXCJSZMZWTKA-BUHFOSPRSA-N
Mol Weight 322.42 g/mol
Molecular Formula C17H22O4S
Exact Mass 322.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 827KHIhsSZt
Name (E)-3-Ethoxymethoxy-1-(phenylsulfonyl)oct-1-en-6-yne
Alternate Name(s) (1E)-3-(ethoxymethoxy)-1-octen-6-ynyl phenyl sulfone {[(1E)-3-(ethoxymethoxy)-1-octen-6-ynyl]sulfonyl}benzene
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Formula C17H22O4S
InChI InChI=1S/C17H22O4S/c1-3-5-7-10-16(21-15-20-4-2)13-14-22(18,19)17-11-8-6-9-12-17/h6,8-9,11-14,16H,4,7,10,15H2,1-2H3/b14-13+
InChIKey ZQXXCJSZMZWTKA-BUHFOSPRSA-N
Molecular Weight 322.419 g/mol
SMILES C(\C=C\S(=O)(=O)c1ccccc1)(OCOCC)CCC#CC
SPLASH splash10-0a6r-9300000000-802c73271e9ac04f2bbc
Source of Spectrum QE-7-2442-3
Wiley ID 845627