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SOH-804 / 16:0-10OH / 10-Hydroxyhexadecanoic acid ME |
Names: Methyl 10-hydroxyhexadecanoate; Methyl 10-hydroxypalmitate; 10-Hydroxyhexadecanoic acid methyl ester
Formula: C17H34O3
Molar mass: 286.454 Da
Monoisotopic mass: 286.251 Da
SMILES: CCCCCCC(O)CCCCCCCCC(=O)OC
InChI Key: CEVXFMILZMQBSZ-UHFFFAOYSA-N
InChI: 1S/C17H34O3/c1-3-4-5-10-13-16(18)14-11-8-6-7-9-12-15-17(19)20-2/h16,18H,3-15H2,1-2H3
Typical retention indexes:
- ECL on BPX70: 23.323
- ECL on Wax: 21.813
- ECL on DB225: 20.944
- ECL on 5% phenyl: 17.930
- KI on Wax: 2813
- KI on DB225: 2698
- KI on 5% phenyl: 2120
Name: 10-Hydroxyhexadecanoic acid
Formula: C16H32O3
Molar mass: 272.427 Da
SMILES: CCCCCCC(O)CCCCCCCCC(O)=O
InChI Key: QUFMVAWAOYDYFV-UHFFFAOYSA-N
InChI: 1S/C16H32O3/c1-2-3-4-9-12-15(17)13-10-7-5-6-8-11-14-16(18)19/h15,17H,2-14H2,1H3,(H,18,19)
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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. |