SpectraBase Compound ID | Io8deU8MDHd |
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InChI | InChI=1S/C17H19F3N2O3/c1-2-25-14-8-4-3-6-12(14)21-16(24)13-7-5-10-22(13)11-9-15(23)17(18,19)20/h3-4,6,8-9,11,13H,2,5,7,10H2,1H3,(H,21,24)/b11-9+ |
InChIKey | KKZCZBWIQPKSGU-PKNBQFBNSA-N |
Mol Weight | 356.35 g/mol |
Molecular Formula | C17H19F3N2O3 |
Exact Mass | 356.134777 g/mol |
SpectraBase Spectrum ID | IkaRG75H7LN |
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Name | N-(2-ethoxyphenyl)-1-[(1E)-4,4,4-trifluoro-3-oxo-1-butenyl]-2-pyrrolidinecarboxamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 356.134776966 u |
Formula | C17H19F3N2O3 |
InChI | InChI=1S/C17H19F3N2O3/c1-2-25-14-8-4-3-6-12(14)21-16(24)13-7-5-10-22(13)11-9-15(23)17(18,19)20/h3-4,6,8-9,11,13H,2,5,7,10H2,1H3,(H,21,24)/b11-9+ |
InChIKey | KKZCZBWIQPKSGU-PKNBQFBNSA-N |
Molecular Weight | 356.345 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_8677 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13219981 |