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2-(phenylethynyl)benzal diacetate
SpectraBase Compound ID AmR3ySKiEjA
InChI InChI=1S/C19H16O4/c1-14(20)22-19(23-15(2)21)18-11-7-6-10-17(18)13-12-16-8-4-3-5-9-16/h3-11,19H,1-2H3
InChIKey RCSNOAGASVHNNK-UHFFFAOYSA-N
Mol Weight 308.33 g/mol
Molecular Formula C19H16O4
Exact Mass 308.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fJVZqI96XW
Name 2-(phenylethynyl)benzal diacetate
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.104858991 u
Formula C19H16O4
InChI InChI=1S/C19H16O4/c1-14(20)22-19(23-15(2)21)18-11-7-6-10-17(18)13-12-16-8-4-3-5-9-16/h3-11,19H,1-2H3
InChIKey RCSNOAGASVHNNK-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202101682
Quality 4
Reported Formula C19H16O4
SMILES C1=CC(=C(C=C1)C#CC1=CC=CC=C1)C(OC(C)=O)OC(C)=O
SPLASH splash10-0a4i-0290000000-12240fa7fa5b6e1d2a67
Source of Spectrum ACI-60-SM11-1i (DOI: 10.1002/anie.202101682)
Wiley ID 1891232