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2-Heptyl-3-(2-phenylethynyl)-2H-furan-5-one
SpectraBase Compound ID 5Xydn7dCJSC
InChI InChI=1S/C19H22O2/c1-2-3-4-5-9-12-18-17(15-19(20)21-18)14-13-16-10-7-6-8-11-16/h6-8,10-11,15,18H,2-5,9,12H2,1H3
InChIKey WPMARWDLDDDBSS-UHFFFAOYSA-N
Mol Weight 282.38 g/mol
Molecular Formula C19H22O2
Exact Mass 282.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1upO6h6ABC6
Name 2-Heptyl-3-(2-phenylethynyl)-2H-furan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O2
InChI InChI=1S/C19H22O2/c1-2-3-4-5-9-12-18-17(15-19(20)21-18)14-13-16-10-7-6-8-11-16/h6-8,10-11,15,18H,2-5,9,12H2,1H3
InChIKey WPMARWDLDDDBSS-UHFFFAOYSA-N
Molecular Weight 282.383 g/mol
SMILES C(C1=CC(=O)OC1CCCCCCC)#Cc1ccccc1
SPLASH splash10-004i-0900000000-502084e78875a0e2c5f1
Source of Spectrum F-55-12144-3
Wiley ID 839509