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Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
Butanedioic acid, 3-sulfo-, 1-[2-[(1-oxo-hexadecyl)amino]ethyl] ester, sodium salt

Molecular and structural information

Molecular formula:
C22H39NNa2O8S
Molecular weight:
ca. 523
SMILES notation:
O=C(OCCNC(CCCCCCCCCCCCCCC)=O)CC(S(=O)([O-])=O)C([O-])=O.[Na+].[Na+]
InChl:
InChI=1S/C22H41NO8S.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(24)23-16-17-31-21(25)18-19(22(26)27)32(28,29)30;;/h19H,2-18H2,1H3,(H,23,24)(H,26,27)(H,28,29,30);;/q;2*+1/p-2
Structural formula:
Chemical structure