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Substance Name: Calcium (Z)-hexadec-9-enoate
RN: 67627-68-3
InChIKey: UPDJPSZNDASPIT-ATMONBRVSA-L

Molecular Formula

  • C16-H30-O2.1/2Ca

Molecular Weight

  • 546.8842
 
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Names and Synonyms

Synonym

  • EINECS 266-774-9

Systematic Name

  • Calcium (Z)-hexadec-9-enoate

Registry Numbers

CAS Registry Number

  • 67627-68-3

System Generated Number

  • 0067627683

Molecular Formulas

Molecular Formula

  • C16-H30-O2.1/2Ca

Molecular Formula Fragments

  • C16-H30-O2
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C16H30O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;/h2*7-8H,2-6,9-15H2,1H3,(H,17,18);/q;;+2/p-2/b2*8-7-;

InChIKey

UPDJPSZNDASPIT-ATMONBRVSA-L

Smiles

CCCCCC/C=C\CCCCCCCC(=O)[O-].CCCCCC/C=C\CCCCCCCC(=O)[O-].[Ca+2]