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Methyl (2E)-[bis(trifluoroethyl)phosphono]butenoate
SpectraBase Compound ID 6jWQ5A3jNEp
InChI InChI=1S/C9H11F6O5P/c1-18-7(16)3-2-4-21(17,19-5-8(10,11)12)20-6-9(13,14)15/h2-3H,4-6H2,1H3/b3-2+
InChIKey OGNHASWWVBCNLM-NSCUHMNNSA-N
Mol Weight 344.15 g/mol
Molecular Formula C9H11F6O5P
Exact Mass 344.024829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtZBJZIoNOZ
Name Methyl (2E)-[bis(trifluoroethyl)phosphono]butenoate
Alternate Name(s) methyl (2E)-4-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-butenoate
Comments Less than 3 mono-isotopic peaks
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Formula C9H11F6O5P
InChI InChI=1S/C9H11F6O5P/c1-18-7(16)3-2-4-21(17,19-5-8(10,11)12)20-6-9(13,14)15/h2-3H,4-6H2,1H3/b3-2+
InChIKey OGNHASWWVBCNLM-NSCUHMNNSA-N
Molecular Weight 344.146 g/mol
SMILES C(OP(OCC(F)(F)F)(=O)C\C=C\C(=O)OC)C(F)(F)F
SPLASH splash10-001i-0090000000-5f03440f2f34c52f4edf
Source of Spectrum KC-0-3075-21
Wiley ID 831532