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SAD-443 / Glutaric acid dME / Pentanedioic acid dME |
Names: Dimethyl pentanedioate; Pentanedioic acid dimethyl ester; Glutaric acid dimethyl ester
Formula: C7H12O4
Molar mass: 160.169 Da
Monoisotopic mass: 160.074 Da
SMILES: COC(=O)CCCC(=O)OC
InChI Key: XTDYIOOONNVFMA-UHFFFAOYSA-N
InChI: 1S/C7H12O4/c1-10-6(8)4-3-5-7(9)11-2/h3-5H2,1-2H3
Typical retention indexes:
- ECL on BPX70: 12.337
Names: Pentanedioic acid; Glutaric acid
Formula: C5H8O4
Molar mass: 132.116 Da
SMILES: OC(=O)CCCC(O)=O
InChI Key: JFCQEDHGNNZCLN-UHFFFAOYSA-N
InChI: 1S/C5H8O4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)
ChEBI code: CHEBI:17859
Lipid Maps code: LMFA01170046
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Data are acquired on Agilent 5972, 5973 and 5975 instruments at Nofima, Institute of Marine Research and University of Bergen. Molecular structures are created in Open Babel. |