(1E)-2-Diazonio-3,3,3-trifluoro-1-{[(2E,6E)-8-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2,6-dimethyl-2,6-octadien-1-yl]oxy}-1-propen-1-olate
[CAS# 88887-99-4]

Identification

• Name: (1E)-2-Diazonio-3,3,3-trifluoro-1-{[(2E,6E)-8-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2,6-dimethyl-2,6-octadien-1-yl]oxy}-1-propen-1-olate
• Synonyms: 2-Diazo-3-trifluoropropionyloxy geranyl pyrophosphate; 2-Diazo-3-trifluoropropionyloxy-geranyl diphosphate
• Molecular Formula: C₁₃H₁₉F₃N₂O₉P₂
• Molecular Weight: 466.24
• CAS Registry Number: 88887-99-4
• SMILES: FC(F)(F)C(/[N+]#N)=C(/[O-])OCC(=C\CC/C(=C/COP(=O)(O)OP(=O)(O)O)C)\C
• InChI: 1S/C13H19F3N2O9P2/c1-9(6-7-26-29(23,24)27-28(20,21)22)4-3-5-10(2)8-25-12(19)11(18-17)13(14,15)16/h5-6H,3-4,7-8H2,1-2H3,(H3-,19,20,21,22,23,24)/b9-6+,10-5+,12-11+
• InChIKey: PXULTBXGKTVWSP-VKJZGPBJSA-N