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BENZYL-(2S)-N-TERT.-BUTOXYCARBONYL-4-DIFLUOROMETHYLENEPROLINATE
SpectraBase Compound ID KD9FDBHiwQa
InChI InChI=1S/C18H21F2NO4/c1-18(2,3)25-17(23)21-10-13(15(19)20)9-14(21)16(22)24-11-12-7-5-4-6-8-12/h4-8,14H,9-11H2,1-3H3/t14-/m0/s1
InChIKey NMAXQXNFYRENIW-AWEZNQCLSA-N
Mol Weight 353.37 g/mol
Molecular Formula C18H21F2NO4
Exact Mass 353.143864 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EIW2RVABs2
Name Benzyl (2S)-N-tert-Butoxycarbonyl-4-trifluoromethyleneprolinate
Alternate Name(s) (2S)-4-(difluoromethylidene)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-(phenylmethyl) ester 2-O-benzyl 1-O-tert-butyl (2S)-4-(difluoromethylidene)pyrrolidine-1,2-dicarboxylate O2-benzyl O1-tert-butyl (2S)-4-(difluoromethylene)pyrrolidine-1,2-dicarboxylate O1-tert-butyl O2-(phenylmethyl) (2S)-4-[bis(fluoranyl)methylidene]pyrrolidine-1,2-dicarboxylate
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Formula C18H21F2NO4
InChI InChI=1S/C18H21F2NO4/c1-18(2,3)25-17(23)21-10-13(15(19)20)9-14(21)16(22)24-11-12-7-5-4-6-8-12/h4-8,14H,9-11H2,1-3H3/t14-/m0/s1
InChIKey NMAXQXNFYRENIW-AWEZNQCLSA-N
Molecular Weight 353.366 g/mol
SMILES C(N1[C@@](CC(C1)=C(F)F)(C(OCc1ccccc1)=O)[H])(OC(C)(C)C)=O
SPLASH splash10-0a4l-9110000000-a2cecdda7a0dc56b3e8f
Source of Spectrum F-67-7164-8
Wiley ID 1571021