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N-Cyclohexyl-N-ethyl-5-hydroxyvaleramide tfa
SpectraBase Compound ID 7UMgVIDy1O2
InChI InChI=1S/C15H24F3NO3/c1-2-19(12-8-4-3-5-9-12)13(20)10-6-7-11-22-14(21)15(16,17)18/h12H,2-11H2,1H3
InChIKey WKPGLPIWYVOECT-UHFFFAOYSA-N
Mol Weight 323.36 g/mol
Molecular Formula C15H24F3NO3
Exact Mass 323.170828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1TnWkjmaV1i
Name N-Cyclohexyl-N-ethyl-5-hydroxyvaleramide tfa
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.170828123 u
Formula C15H24F3NO3
InChI InChI=1S/C15H24F3NO3/c1-2-19(12-8-4-3-5-9-12)13(20)10-6-7-11-22-14(21)15(16,17)18/h12H,2-11H2,1H3
InChIKey WKPGLPIWYVOECT-UHFFFAOYSA-N
Molecular Weight 323.356 g/mol
SMILES C1(N(C(CCCCOC(C(F)(F)F)=O)=O)CC)CCCCC1