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2-Hydroxymethylene-4,4-dimethyl-3-oxocyclopentanecarboxylic acid, methyl ester
SpectraBase Compound ID CjdxfglqK5f
InChI InChI=1S/C10H14O4/c1-10(2)4-6(9(13)14-3)7(5-11)8(10)12/h5-6,11H,4H2,1-3H3/b7-5+
InChIKey ZZZGACKJRNBVPJ-FNORWQNLSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AH4ucUOjTbu
Name 2-Hydroxymethylene-4,4-dimethyl-3-oxocyclopentanecarboxylic acid, methyl ester
CAS Registry Number 78092-05-4
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-10(2)4-6(9(13)14-3)7(5-11)8(10)12/h5-6,11H,4H2,1-3H3/b7-5+
InChIKey ZZZGACKJRNBVPJ-FNORWQNLSA-N
Molecular Weight 198.218 g/mol
SMILES O\C=C\1C(=O)C(C)(CC1C(OC)=O)C
SPLASH splash10-01pc-6900000000-1e094bfe2fc60233e120
Synonyms Methyl (2E)-2-(hydroxymethylene)-4,4-dimethyl-3-oxocyclopentanecarboxylate Methyl (2E)-2-(hydroxymethylidene)-4,4-dimethyl-3-oxocyclopentane-1-carboxylate
Wiley ID 1479807