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Diethyl 3-methylcyclopent-3-ene-1,1-dicarboxylate
SpectraBase Compound ID EvumMUhECMr
InChI InChI=1S/C12H18O4/c1-4-15-10(13)12(11(14)16-5-2)7-6-9(3)8-12/h6H,4-5,7-8H2,1-3H3
InChIKey SNOPMSXDMMRDGF-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvGYMexzf1B
Name Diethyl 3-methylcyclopent-3-ene-1,1-dicarboxylate
Appearance Colorless oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.120509056 u
Formula C12H18O4
GC Oven Program Oven temp 310 oC
InChI InChI=1S/C12H18O4/c1-4-15-10(13)12(11(14)16-5-2)7-6-9(3)8-12/h6H,4-5,7-8H2,1-3H3
InChIKey SNOPMSXDMMRDGF-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.202112101
Molecular Weight 226.272 g/mol
Quality 735
SMILES C1(C(OCC)=O)(C(=O)OCC)CC(=CC1)C
SPLASH splash10-0ugi-8900000000-6580f04682f5398bd4ef
Source of Spectrum ACI-61-SM63-S2 (DOI: 10.1002/anie.202112101)
Wiley ID 1897699