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(1R*,4R*)-(Z)-1-Acetoxy-4-[benzyl(diphenylmethyl)amino]cyclohex-2-ene
SpectraBase Compound ID 12v1gaVAGgd
InChI InChI=1S/C28H29NO2/c1-22(30)31-27-19-17-26(18-20-27)29(21-23-11-5-2-6-12-23)28(24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-17,19,26-28H,18,20-21H2,1H3/t26-,27+/m1/s1
InChIKey QHFJXZOZYFLHKY-SXOMAYOGSA-N
Mol Weight 411.55 g/mol
Molecular Formula C28H29NO2
Exact Mass 411.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1WHwLJoPdg
Name (1R*,4R*)-(Z)-1-Acetoxy-4-[benzyl(diphenylmethyl)amino]cyclohex-2-ene
Alternate Name(s) (1R,4S)-4-[benzhydryl(benzyl)amino]-2-cyclohexen-1-yl acetate (Z)-1-Acetoxy-4-[benzyl(diphenylmethyl)amino]cyclohex-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29NO2
InChI InChI=1S/C28H29NO2/c1-22(30)31-27-19-17-26(18-20-27)29(21-23-11-5-2-6-12-23)28(24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-17,19,26-28H,18,20-21H2,1H3/t26-,27+/m1/s1
InChIKey QHFJXZOZYFLHKY-SXOMAYOGSA-N
Molecular Weight 411.545 g/mol
SMILES C(N([C@@]1(C=C[C@](OC(=O)C)(CC1)[H])[H])Cc1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-002f-9107100000-9ba395d2d09296726011
Source of Spectrum C-120-6668-9
Wiley ID 761060