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4-Chloro-2-(1-hexynyl)-3-methoxy-4-phenyl-2-cyclobuten-1-one

View entire compound with spectra: 1 MS (GC)

4-Chloro-2-(1-hexynyl)-3-methoxy-4-phenyl-2-cyclobuten-1-one
SpectraBase Compound ID Fri1LGPdvAu
InChI InChI=1S/C17H17ClO2/c1-3-4-5-9-12-14-15(19)17(18,16(14)20-2)13-10-7-6-8-11-13/h6-8,10-11H,3-5H2,1-2H3
InChIKey ZVTABEVRVSTRPS-UHFFFAOYSA-N
Mol Weight 288.77 g/mol
Molecular Formula C17H17ClO2
Exact Mass 288.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZcH9pVu0BV
Name 4-Chloro-2-(1-hexynyl)-3-methoxy-4-phenyl-2-cyclobuten-1-one
CAS Registry Number 122746-02-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClO2
InChI InChI=1S/C17H17ClO2/c1-3-4-5-9-12-14-15(19)17(18,16(14)20-2)13-10-7-6-8-11-13/h6-8,10-11H,3-5H2,1-2H3
InChIKey ZVTABEVRVSTRPS-UHFFFAOYSA-N
Molecular Weight 288.774 g/mol
SMILES C1(=C(OC)C(C1=O)(c1ccccc1)Cl)C#CCCCC
SPLASH splash10-07e0-9820000000-6fd7d207d24b7055a91e
Source of Spectrum J-57-335-0
Wiley ID 1291794