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Substance Name: Iron abietate, technical
RN: 74356-11-9
InChIKey: OFFKQZOHDWKCMB-KPFNJKCZSA-K

Molecular Formula

  • C20-H30-O2.x-Fe

Molecular Weight

  • 960.1863
 
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Names and Synonyms

Synonym

  • EINECS 277-835-4

Systematic Name

  • Iron abietate, technical

Registry Numbers

CAS Registry Number

  • 74356-11-9

System Generated Number

  • 0074356119

Molecular Formulas

Molecular Formula

  • C20-H30-O2.x-Fe

Molecular Formula Fragments

  • C20-H30-O2
  • COMPONENT
  • Fe

Structure Descriptors

InChI

1S/3C20H30O2.Fe/c3*1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h3*7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22);/q;;;+3/p-3/t3*16-,17-,19-,20+;/m111./s1

InChIKey

OFFKQZOHDWKCMB-KPFNJKCZSA-K

Smiles

[Fe+3].CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@]3(C)C(=O)[O-])[C@@H]2CC1.CC(C)C4=CC5=CC[C@@H]6[C@](C)(CCC[C@]6(C)C(=O)[O-])[C@@H]5CC4.CC(C)C7=CC8=CC[C@@H]9[C@](C)(CCC[C@]9(C)C(=O)[O-])[C@@H]8CC7