For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,4R)-1-(tert-butoxycarbonyl)-4-vinylpyrrolidine-2-carboxylic acid
SpectraBase Compound ID J8fk4zXnoCB
InChI InChI=1S/C12H19NO4/c1-5-8-6-9(10(14)15)13(7-8)11(16)17-12(2,3)4/h5,8-9H,1,6-7H2,2-4H3,(H,14,15)/t8-,9-/m0/s1
InChIKey LYORHNLHOUNMQH-IUCAKERBSA-N
Mol Weight 241.29 g/mol
Molecular Formula C12H19NO4
Exact Mass 241.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8nWsn00i9HZ
Name (2S,4R)-1-(tert-butoxycarbonyl)-4-vinylpyrrolidine-2-carboxylic acid
Appearance Colorless solid
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO4
GC Oven Program Oven temp 300oC
InChI InChI=1S/C12H19NO4/c1-5-8-6-9(10(14)15)13(7-8)11(16)17-12(2,3)4/h5,8-9H,1,6-7H2,2-4H3,(H,14,15)/t8-,9-/m0/s1
InChIKey LYORHNLHOUNMQH-IUCAKERBSA-N
Instrument Name Agilent HP6890-5937N
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202200372
Molecular Weight 241.287 g/mol
Optical Rotation [a]D20 = -97.27(c = 0.305, CHCl3)
Reported Formula C12H19NO4
SMILES OC([C@]1(N(C[C@](C1)(C=C)[H])C(=O)OC(C)(C)C)[H])=O
SPLASH splash10-0a4m-9300000000-31f09967410c88664605
Sample Comments dr = 10:1
Source of Spectrum CBC-23-SM6-1
Thin-Layer Chromatography Rf = 0.24 (EtOAc/cHex/HOAc 1:2:0.01)
Wiley ID 1876081