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2-Propargyl-1,3-bis(4-tolyl)propan-1,3-dione
SpectraBase Compound ID 3j3rsEIPTJb
InChI InChI=1S/C20H18O2/c1-4-5-18(19(21)16-10-6-14(2)7-11-16)20(22)17-12-8-15(3)9-13-17/h1,6-13,18H,5H2,2-3H3
InChIKey OVQVUDYQYZFRGK-UHFFFAOYSA-N
Mol Weight 290.36 g/mol
Molecular Formula C20H18O2
Exact Mass 290.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hays4goSRfz
Name 2-Propargyl-1,3-bis(4-tolyl)propan-1,3-dione
Alternate Name(s) 1,3-bis(4-methylphenyl)-2-(2-propynyl)-1,3-propanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O2
InChI InChI=1S/C20H18O2/c1-4-5-18(19(21)16-10-6-14(2)7-11-16)20(22)17-12-8-15(3)9-13-17/h1,6-13,18H,5H2,2-3H3
InChIKey OVQVUDYQYZFRGK-UHFFFAOYSA-N
Molecular Weight 290.362 g/mol
SMILES C(C(c1ccc(cc1)C)=O)(C(c1ccc(cc1)C)=O)CC#C
SPLASH splash10-014i-1900000000-5d96f8daa829b61290fd
Source of Spectrum SO-0-136-4
Wiley ID 873260