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Tetraethyl 1-methylpyrrolidine-3,3-diyldiphosphonate
SpectraBase Compound ID LXgUettQ7mT
InChI InChI=1S/C13H29NO6P2/c1-6-17-21(15,18-7-2)13(10-11-14(5)12-13)22(16,19-8-3)20-9-4/h6-12H2,1-5H3
InChIKey IBHIFGPCTLHWBS-UHFFFAOYSA-N
Mol Weight 357.32 g/mol
Molecular Formula C13H29NO6P2
Exact Mass 357.147012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4Ydg103A0G
Name Tetraethyl 1-methylpyrrolidine-3,3-diyldiphosphonate
Carrier Gas (0.8 ml/min)
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Exact Mass 357.147011648 u
Formula C13H29NO6P2
GC Column HP5-MS (30 m x 0.2 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C13H29NO6P2/c1-6-17-21(15,18-7-2)13(10-11-14(5)12-13)22(16,19-8-3)20-9-4/h6-12H2,1-5H3
InChIKey IBHIFGPCTLHWBS-UHFFFAOYSA-N
Instrument Name GC Trace GC 2000-quadrupole MS Thermo Finnigan Trace
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605878
Molecular Weight 357.324 g/mol
Quality 888
SMILES C1CC(CN1C)(P(=O)(OCC)OCC)P(OCC)(=O)OCC
SPLASH splash10-02u0-8980000000-c32e92f224058600bd51
Source of Spectrum QE-23-SM3-SAR1 (DOI: 10.1002/chem.201605878)
Wiley ID 1907797