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Ethyl (2S)-N-(3-ethoxy-3-oxopropyl)-4,4-difluoroprolinate
SpectraBase Compound ID JBqr1j6Zecu
InChI InChI=1S/C12H19F2NO4/c1-3-18-10(16)5-6-15-8-12(13,14)7-9(15)11(17)19-4-2/h9H,3-8H2,1-2H3/t9-/m0/s1
InChIKey CWTIANMQDCOUSZ-VIFPVBQESA-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 2mWIs04N6SW
Name Ethyl (2S)-N-(3-ethoxy-3-oxopropyl)-4,4-difluoroprolinate
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19F2NO4
InChI InChI=1S/C12H19F2NO4/c1-3-18-10(16)5-6-15-8-12(13,14)7-9(15)11(17)19-4-2/h9H,3-8H2,1-2H3/t9-/m0/s1
InChIKey CWTIANMQDCOUSZ-VIFPVBQESA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202200081
Molecular Weight 279.284 g/mol
Reported Formula C12H19F2NO4
SMILES C1(CN([C@@](C1)(C(OCC)=O)[H])CCC(OCC)=O)(F)F
SPLASH splash10-0a4i-4970000000-0aa5d366adda68120774
Source of Spectrum CBC-23-SM24-8
Wiley ID 1871735