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4-Cyclopentene-1,3-dione, 4-(3-methyl-2-butenyl)-5-(2-phenylethyl)-
SpectraBase Compound ID EHBtdlNDesy
InChI InChI=1S/C18H20O2/c1-13(2)8-10-15-16(18(20)12-17(15)19)11-9-14-6-4-3-5-7-14/h3-8H,9-12H2,1-2H3
InChIKey DBIYTPOXCGIGSA-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4Iib8yqjOS
Name 4-Cyclopentene-1,3-dione, 4-(3-methyl-2-butenyl)-5-(2-phenylethyl)-
CAS Registry Number 57803-27-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-13(2)8-10-15-16(18(20)12-17(15)19)11-9-14-6-4-3-5-7-14/h3-8H,9-12H2,1-2H3
InChIKey DBIYTPOXCGIGSA-UHFFFAOYSA-N
Molecular Weight 268.356 g/mol
SMILES C1(=C(C(=O)CC1=O)CCc1ccccc1)CC=C(C)C
SPLASH splash10-00mo-5290000000-6976ee1ffa1d09f57b78
Source of Spectrum AN-84-822-0
Synonyms 2-(.beta.-phenylethyl)-3-(3'-methyl-2'-butenyl)-2-cyclopenten-1,4-dione 4-(3-Methyl-2-butenyl)-5-(2-phenylethyl)-4-cyclopentene-1,3-dione
Wiley ID 1272591