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4-Cyclohexene-1,2-dicarboxylic acid, dimethyl ester
SpectraBase Compound ID 4n4cH9ixThw
InChI InChI=1S/C10H14O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-4,7-8H,5-6H2,1-2H3
InChIKey DVVAGRMJGUQHLI-UHFFFAOYSA-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 F54JEAIhYdq
Name Captafol artifact-1 2ME @
CAS Registry Number 74663-82-4
Classification Fungicide
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Exact Mass 198.089208927 u
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-4,7-8H,5-6H2,1-2H3
InChIKey DVVAGRMJGUQHLI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 198.218 g/mol
SMILES C1(C(C(=O)OC)CC=CC1)C(=O)OC
SPLASH splash10-004i-9400000000-2e29876e31e794da6ef8
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Captafol artifact-1 (cyclohexenedicarboxylic acid) 2ME Captan artifact-1 (cyclohexenedicarboxylic acid) 2ME
Technique GC/MS
Wiley ID MMPW6e_4206