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[(3S)-3-ethyl-2-[[(1R)-1-phenylethyl]amino]-1-cyclohexenyl]-phenylmethanone
SpectraBase Compound ID I4YqIKhVKa5
InChI InChI=1S/C23H27NO/c1-3-18-15-10-16-21(23(25)20-13-8-5-9-14-20)22(18)24-17(2)19-11-6-4-7-12-19/h4-9,11-14,17-18,24H,3,10,15-16H2,1-2H3/t17-,18+/m1/s1
InChIKey HEYGYOWLCJGJGB-MSOLQXFVSA-N
Mol Weight 333.48 g/mol
Molecular Formula C23H27NO
Exact Mass 333.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOHdimoxNVK
Name [(3S)-3-ethyl-2-[[(1R)-1-phenylethyl]amino]-1-cyclohexenyl]-phenylmethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO
InChI InChI=1S/C23H27NO/c1-3-18-15-10-16-21(23(25)20-13-8-5-9-14-20)22(18)24-17(2)19-11-6-4-7-12-19/h4-9,11-14,17-18,24H,3,10,15-16H2,1-2H3/t17-,18+/m1/s1
InChIKey HEYGYOWLCJGJGB-MSOLQXFVSA-N
Molecular Weight 333.475 g/mol
SMILES N(C1=C(C(=O)c2ccccc2)CCC[C@@]1(CC)[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-056r-2981000000-5005968ea4644e20f087
Source of Spectrum QC-4-1661-2
Synonyms [(3S)-3-ethyl-2-[[(1R)-1-phenylethyl]amino]cyclohexen-1-yl]-phenyl-methanone
Wiley ID 883375