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4-(2-cyclohexylidene-1-phenylsulfanyl-ethenyl)-2,3-dimethoxy-4-oxidanyl-cyclobut-2-en-1-one
SpectraBase Compound ID Fm8qQIfNBkj
InChI InChI=1S/C20H22O4S/c1-23-17-18(21)20(22,19(17)24-2)16(13-14-9-5-3-6-10-14)25-15-11-7-4-8-12-15/h4,7-8,11-12,22H,3,5-6,9-10H2,1-2H3
InChIKey DMBOZEDDUWQYRR-UHFFFAOYSA-N
Mol Weight 358.45 g/mol
Molecular Formula C20H22O4S
Exact Mass 358.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EK6GwwqYli2
Name 4-(2-cyclohexylidene-1-phenylsulfanyl-ethenyl)-2,3-dimethoxy-4-oxidanyl-cyclobut-2-en-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O4S
InChI InChI=1S/C20H22O4S/c1-23-17-18(21)20(22,19(17)24-2)16(13-14-9-5-3-6-10-14)25-15-11-7-4-8-12-15/h4,7-8,11-12,22H,3,5-6,9-10H2,1-2H3
InChIKey DMBOZEDDUWQYRR-UHFFFAOYSA-N
Molecular Weight 358.452 g/mol
SMILES OC1(C(OC)=C(C1=O)OC)C(=C=C1CCCCC1)Sc1ccccc1
SPLASH splash10-0a4i-0049000000-818f996bd208a0a5ab48
Source of Spectrum J-61-336-9
Synonyms 4-(2-cyclohexylidene-1-phenylsulfanyl-vinyl)-4-hydroxy-2,3-dimethoxy-cyclobut-2-en-1-one 4-(2-cyclohexylidene-1-phenylsulfanylethenyl)-4-hydroxy-2,3-dimethoxycyclobut-2-en-1-one 4-[2-cyclohexylidene-1-(phenylthio)ethenyl]-4-hydroxy-2,3-dimethoxy-1-cyclobut-2-enone 4-[2-cyclohexylidene-1-(phenylthio)vinyl]-4-hydroxy-2,3-dimethoxy-cyclobut-2-en-1-one
Wiley ID 1347034