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1-tert-butyl 2-ethyl (S)-4,4-difluoropyrrolidine-1,2-dicarboxylate
SpectraBase Compound ID BsPbGCQgeIJ
InChI InChI=1S/C12H19F2NO4/c1-5-18-9(16)8-6-12(13,14)7-15(8)10(17)19-11(2,3)4/h8H,5-7H2,1-4H3/t8-/m0/s1
InChIKey CMNMGOSQTYXYGN-QMMMGPOBSA-N
Mol Weight 279.28 g/mol
Molecular Formula C12H19F2NO4
Exact Mass 279.128214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNqkXBziIbZ
Name 1-tert-butyl 2-ethyl (S)-4,4-difluoropyrrolidine-1,2-dicarboxylate
Appearance Colorless oil
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Formula C12H19F2NO4
InChI InChI=1S/C12H19F2NO4/c1-5-18-9(16)8-6-12(13,14)7-15(8)10(17)19-11(2,3)4/h8H,5-7H2,1-4H3/t8-/m0/s1
InChIKey CMNMGOSQTYXYGN-QMMMGPOBSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202200081
Molecular Weight 279.284 g/mol
Reported Formula C12H20F2NO2
SMILES C1(CN([C@@](C1)(C(OCC)=O)[H])C(OC(C)(C)C)=O)(F)F
SPLASH splash10-0a4i-7920000000-b62bb369a10542619f37
Source of Spectrum CBC-23-SM20-7
Wiley ID 1871734