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((2-Anthracenethio)ethyl)-4-hydroxy-3-methoxy-4-((3-trimethylsilyl)-1-propynyl)-2-cyclobuten-1-one
SpectraBase Compound ID LAVQDxtAkBe
InChI InChI=1S/C27H28O3SSi/c1-30-26-23(25(28)27(26,29)15-9-17-32(2,3)4)14-16-31-24-21-12-7-5-10-19(21)18-20-11-6-8-13-22(20)24/h5-8,10-13,18,29H,14,16-17H2,1-4H3
InChIKey JPSGHGXZKHOQEL-UHFFFAOYSA-N
Mol Weight 460.66 g/mol
Molecular Formula C27H28O3SSi
Exact Mass 460.152842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjaJv7b3F86
Name ((2-Anthracenethio)ethyl)-4-hydroxy-3-methoxy-4-((3-trimethylsilyl)-1-propynyl)-2-cyclobuten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28O3SSi
InChI InChI=1S/C27H28O3SSi/c1-30-26-23(25(28)27(26,29)15-9-17-32(2,3)4)14-16-31-24-21-12-7-5-10-19(21)18-20-11-6-8-13-22(20)24/h5-8,10-13,18,29H,14,16-17H2,1-4H3
InChIKey JPSGHGXZKHOQEL-UHFFFAOYSA-N
Molecular Weight 460.663 g/mol
SMILES OC1(C(OC)=C(C1=O)CCSc1c2c(cccc2)cc2c1cccc2)C#CC[Si](C)(C)C
SPLASH splash10-0w29-3490500000-de12527e10a36fcf8310
Source of Spectrum KC-61-285-30
Synonyms 2-[2-(9-anthrylsulfanyl)ethyl]-4-hydroxy-3-methoxy-4-[3-(trimethylsilyl)-1-propynyl]-2-cyclobuten-1-one
Wiley ID 1626979