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2-Cyclopentene-1,1-dicarboxylic acid, 3-methyl-4-(phenylmethylene)-, diethyl ester
SpectraBase Compound ID 5BgDjYDFpcx
InChI InChI=1S/C19H22O4/c1-4-22-17(20)19(18(21)23-5-2)12-14(3)16(13-19)11-15-9-7-6-8-10-15/h6-12H,4-5,13H2,1-3H3/b16-11-
InChIKey HFQKQMUUWSPEHV-WJDWOHSUSA-N
Mol Weight 314.38 g/mol
Molecular Formula C19H22O4
Exact Mass 314.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8XCH1crpGII
Name 2-Cyclopentene-1,1-dicarboxylic acid, 3-methyl-4-(phenylmethylene)-, diethyl ester
Alternate Name(s) Diethyl (4Z)-4-benzylidene-3-methyl-2-cyclopentene-1,1-dicarboxylate Diethyl-3-methyl-4-benzylidenecyclopent-2-ene-1,1-dicarboxylate
CAS Registry Number 118453-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O4
InChI InChI=1S/C19H22O4/c1-4-22-17(20)19(18(21)23-5-2)12-14(3)16(13-19)11-15-9-7-6-8-10-15/h6-12H,4-5,13H2,1-3H3/b16-11-
InChIKey HFQKQMUUWSPEHV-WJDWOHSUSA-N
Molecular Weight 314.381 g/mol
SMILES C1(C=C(C)\C(C1)=C/c1ccccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-056r-3900000000-8132317cc33d78d3fd0b
Source of Spectrum F-44-2045-20
Wiley ID 1315247