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(2S,4S)-TERT.-BUTYL-N-TERT.-BUTOXYCARBNONYL-4-DIFLUOROMETHYLPROLINATE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2S,4S)-TERT.-BUTYL-N-TERT.-BUTOXYCARBNONYL-4-DIFLUOROMETHYLPROLINATE
SpectraBase Compound ID 9iMvQ0jrG0M
InChI InChI=1S/C15H25F2NO4/c1-14(2,3)21-12(19)10-7-9(11(16)17)8-18(10)13(20)22-15(4,5)6/h9-11H,7-8H2,1-6H3/t9-,10-/m0/s1
InChIKey HJRTYLUNZUGSLU-UWVGGRQHSA-N
Mol Weight 321.36 g/mol
Molecular Formula C15H25F2NO4
Exact Mass 321.175165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8xCtYOMZTs
Name (2S,4S)-4-(difluoromethyl)pyrrolidine-1,2-dicarboxylic acid ditert-butyl ester
Alternate Name(s) ditert-butyl (2S,4S)-4-(difluoromethyl)pyrrolidine-1,2-dicarboxylate ditert-butyl (2S,4S)-4-[bis(fluoranyl)methyl]pyrrolidine-1,2-dicarboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25F2NO4
InChI InChI=1S/C15H25F2NO4/c1-14(2,3)21-12(19)10-7-9(11(16)17)8-18(10)13(20)22-15(4,5)6/h9-11H,7-8H2,1-6H3/t9-,10-/m0/s1
InChIKey HJRTYLUNZUGSLU-UWVGGRQHSA-N
Molecular Weight 321.365 g/mol
SMILES C(N1[C@](C(OC(C)(C)C)=O)(C[C@@](C1)(C(F)F)[H])[H])(OC(C)(C)C)=O
SPLASH splash10-0ab9-9400000000-a896cd4192cc252e62fd
Source of Spectrum F-68-3617-22
Wiley ID 1572473