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Substance Name: (Z)-(3-Methylbenzoato-O)(octadec-9-enoato-O)barium
RN: 85702-49-4
InChIKey: MOMRBIOOZZNUIV-XXAVUKJNSA-L

Molecular Formula

  • C26-H40-Ba-O4

Molecular Weight

  • 553.928
 
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Names and Synonyms

Synonym

  • EINECS 288-239-9

Systematic Name

  • (Z)-(3-Methylbenzoato-O)(octadec-9-enoato-O)barium

Registry Numbers

CAS Registry Number

  • 85702-49-4

System Generated Number

  • 0085702494

Structure Descriptors

InChI

1S/C18H34O2.C8H8O2.Ba/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-6-3-2-4-7(5-6)8(9)10;/h9-10H,2-8,11-17H2,1H3,(H,19,20);2-5H,1H3,(H,9,10);/q;;+2/p-2/b10-9-;;

InChIKey

MOMRBIOOZZNUIV-XXAVUKJNSA-L

Smiles

CCCCCCCC\C=C/CCCCCCCC(=O)O[Ba]OC(=O)c1cccc(C)c1