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4-[2'-(3''-Methyl-2''-butenyloxy)phenyl]-3-(phenylsulfonyl)-3-buten-2-one
SpectraBase Compound ID 8Hn08LMeKr1
InChI InChI=1S/C21H22O4S/c1-16(2)13-14-25-20-12-8-7-9-18(20)15-21(17(3)22)26(23,24)19-10-5-4-6-11-19/h4-13,15H,14H2,1-3H3/b21-15-
InChIKey KYXJQNLBGHSLHZ-QNGOZBTKSA-N
Mol Weight 370.46 g/mol
Molecular Formula C21H22O4S
Exact Mass 370.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YJLnGHPwhO
Name 4-[2'-(3''-Methyl-2''-butenyloxy)phenyl]-3-(phenylsulfonyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O4S
InChI InChI=1S/C21H22O4S/c1-16(2)13-14-25-20-12-8-7-9-18(20)15-21(17(3)22)26(23,24)19-10-5-4-6-11-19/h4-13,15H,14H2,1-3H3/b21-15-
InChIKey KYXJQNLBGHSLHZ-QNGOZBTKSA-N
Molecular Weight 370.463 g/mol
SMILES c1(\C=C\(S(=O)(=O)c2ccccc2)C(=O)C)c(OCC=C(C)C)cccc1
SPLASH splash10-01b9-9800000000-f0c67ec817e8b7702669
Source of Spectrum AH-132-397-11
Synonyms (3Z)-4-{2-[(3-methyl-2-butenyl)oxy]phenyl}-3-(phenylsulfonyl)-3-buten-2-one (Z)-3-(benzenesulfonyl)-4-[2-(3-methylbut-2-enoxy)phenyl]-3-buten-2-one (Z)-3-(benzenesulfonyl)-4-[2-(3-methylbut-2-enoxy)phenyl]but-3-en-2-one (Z)-4-[2-(3-methylbut-2-enoxy)phenyl]-3-(phenylsulfonyl)but-3-en-2-one
Wiley ID 849911