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(2R,3S,5S)-N-tert-Butyloxycarbonyl-5-cyano-3-vinylpyrrolidine-2-carboxylic acid
SpectraBase Compound ID JKdXRqXU75K
InChI InChI=1S/C13H18N2O4/c1-5-8-6-9(7-14)15(10(8)11(16)17)12(18)19-13(2,3)4/h5,8-10H,1,6H2,2-4H3,(H,16,17)/t8-,9+,10-/m1/s1
InChIKey ZAIJTNWRTBPWLB-KXUCPTDWSA-N
Mol Weight 266.3 g/mol
Molecular Formula C13H18N2O4
Exact Mass 266.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3L0oU70nXE
Name (2R,3S,5S)-N-tert-Butyloxycarbonyl-5-cyano-3-vinylpyrrolidine-2-carboxylic acid
Alternate Name(s) (2R,3S,5S)-1-(tert-butoxycarbonyl)-5-cyano-3-vinyl-2-pyrrolidinecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O4
InChI InChI=1S/C13H18N2O4/c1-5-8-6-9(7-14)15(10(8)11(16)17)12(18)19-13(2,3)4/h5,8-10H,1,6H2,2-4H3,(H,16,17)/t8-,9+,10-/m1/s1
InChIKey ZAIJTNWRTBPWLB-KXUCPTDWSA-N
Molecular Weight 266.297 g/mol
SMILES OC([C@@]1(N(C(OC(C)(C)C)=O)[C@@](C[C@]1(C=C)[H])(C#N)[H])[H])=O
SPLASH splash10-0adi-6900000000-2f0303beed7e733f0a7a
Source of Spectrum SO-0-129-21
Wiley ID 873286