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[(3S)-3-methyl-2-[[(1R)-1-phenylethyl]amino]-1-cyclohexenyl]-phenylmethanone
SpectraBase Compound ID EqAcUuNxxhO
InChI InChI=1S/C22H25NO/c1-16-10-9-15-20(22(24)19-13-7-4-8-14-19)21(16)23-17(2)18-11-5-3-6-12-18/h3-8,11-14,16-17,23H,9-10,15H2,1-2H3/t16-,17+/m0/s1
InChIKey UUBXKYVGLZGRFQ-DLBZAZTESA-N
Mol Weight 319.45 g/mol
Molecular Formula C22H25NO
Exact Mass 319.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKnY8RMuPOl
Name [(3S)-3-methyl-2-[[(1R)-1-phenylethyl]amino]-1-cyclohexenyl]-phenylmethanone
Alternate Name(s) [(3S)-3-methyl-2-[[(1R)-1-phenylethyl]amino]cyclohexen-1-yl]-phenyl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO
InChI InChI=1S/C22H25NO/c1-16-10-9-15-20(22(24)19-13-7-4-8-14-19)21(16)23-17(2)18-11-5-3-6-12-18/h3-8,11-14,16-17,23H,9-10,15H2,1-2H3/t16-,17+/m0/s1
InChIKey UUBXKYVGLZGRFQ-DLBZAZTESA-N
Molecular Weight 319.448 g/mol
SMILES N(C1=C(C(=O)c2ccccc2)CCC[C@@]1(C)[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-08fr-1591000000-a12d9f141e2e799c4e54
Source of Spectrum QC-4-1660-2
Wiley ID 883377