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2-(N-Isopropylamino)-6-phenylhex-2-en-4-one
SpectraBase Compound ID GVGxdzVo1XP
InChI InChI=1S/C15H21NO/c1-12(2)16-13(3)11-15(17)10-9-14-7-5-4-6-8-14/h4-8,11-12,16H,9-10H2,1-3H3/b13-11+
InChIKey HEFQULVEFKZRHS-ACCUITESSA-N
Mol Weight 231.34 g/mol
Molecular Formula C15H21NO
Exact Mass 231.162314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ibNSWYZiyE
Name 2-(N-Isopropylamino)-6-phenylhex-2-en-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.162314299 u
Formula C15H21NO
InChI InChI=1S/C15H21NO/c1-12(2)16-13(3)11-15(17)10-9-14-7-5-4-6-8-14/h4-8,11-12,16H,9-10H2,1-3H3/b13-11+
InChIKey HEFQULVEFKZRHS-ACCUITESSA-N
Molecular Weight 231.339 g/mol
SMILES C(N\C(=C\C(=O)CCC=1C=CC=CC1)C)(C)C