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4-Cyclopentene-1,3-dione, 4-(2-butenyl)-5-(2-methoxyethyl)-
SpectraBase Compound ID 5isxUQhfuhW
InChI InChI=1S/C12H16O3/c1-3-4-5-9-10(6-7-15-2)12(14)8-11(9)13/h3-4H,5-8H2,1-2H3/b4-3+
InChIKey NTSYWXSIEBPJOQ-ONEGZZNKSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Et3WScHGyix
Name 4-Cyclopentene-1,3-dione, 4-(2-butenyl)-5-(2-methoxyethyl)-
CAS Registry Number 57803-26-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-3-4-5-9-10(6-7-15-2)12(14)8-11(9)13/h3-4H,5-8H2,1-2H3/b4-3+
InChIKey NTSYWXSIEBPJOQ-ONEGZZNKSA-N
Molecular Weight 208.257 g/mol
SMILES C1(=C(C(=O)CC1=O)CCOC)C\C=C\C
SPLASH splash10-0002-9620000000-0bf286508da89bc482cd
Source of Spectrum AN-84-822-0
Synonyms 2-(2'-Methoxyethyl)-3-(2''-butenyl)-2-cyclopenten-1,4-dione 2-(2'-Methoxyethyl)-3-(2''-butenyl)-2-cyclopenten-1,4-dione 4-[(2E)-2-butenyl]-5-(2-methoxyethyl)-4-cyclopentene-1,3-dione
Wiley ID 1206752