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1,5-Cyclooctanedicarboxylic acid, dimethyl ester
SpectraBase Compound ID Aronis4pp5Q
InChI InChI=1S/C12H20O4/c1-15-11(13)9-5-3-7-10(8-4-6-9)12(14)16-2/h9-10H,3-8H2,1-2H3
InChIKey SXECLMTWIVGZPZ-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9lXB5LzIxjj
Name 1,5-Cyclooctanedicarboxylic acid, dimethyl ester
CAS Registry Number 55409-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-15-11(13)9-5-3-7-10(8-4-6-9)12(14)16-2/h9-10H,3-8H2,1-2H3
InChIKey SXECLMTWIVGZPZ-UHFFFAOYSA-N
Molecular Weight 228.288 g/mol
SMILES C(=O)(C1CCCC(C(=O)OC)CCC1)OC
SPLASH splash10-014i-0900000000-7fff46df024a8ae139ed
Source of Spectrum C-97-1899-0
Synonyms Dimethyl 1,5-cyclooctanedicarboxylate
Wiley ID 1229518