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3-(4-tert-Butylphenyl)-1-(3-chloroquinoxalin-2-yl)prop-2-yn-1-one
SpectraBase Compound ID 3y5KPR4EihH
InChI InChI=1S/C21H17ClN2O/c1-21(2,3)15-11-8-14(9-12-15)10-13-18(25)19-20(22)24-17-7-5-4-6-16(17)23-19/h4-9,11-12H,1-3H3
InChIKey BUKXOEIWIHQMKV-UHFFFAOYSA-N
Mol Weight 348.83 g/mol
Molecular Formula C21H17ClN2O
Exact Mass 348.102941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKZ5WKVhtha
Name 3-(4-tert-Butylphenyl)-1-(3-chloroquinoxalin-2-yl)prop-2-yn-1-one
Alternate Name(s) 3-(4-(tert-butyl)phenyl)-1-(3-chloroquinoxalin-2-yl)prop-2-yn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17ClN2O
InChI InChI=1S/C21H17ClN2O/c1-21(2,3)15-11-8-14(9-12-15)10-13-18(25)19-20(22)24-17-7-5-4-6-16(17)23-19/h4-9,11-12H,1-3H3
InChIKey BUKXOEIWIHQMKV-UHFFFAOYSA-N
Molecular Weight 348.833 g/mol
SMILES c1(nc2ccccc2nc1Cl)C(C#Cc1ccc(C(C)(C)C)cc1)=O
SPLASH splash10-000i-0905000000-3435bde50e6d9bd0e517
Source of Spectrum F-69-2316-5b
Wiley ID 1737804