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trans-N-(Cyclohexylmethyl)-3-ethoxy-3,4-dihydrospiro[[2]benzopyran-1,1'-cyclohexan]-4'-amine
SpectraBase Compound ID IvFUDfkR7o3
InChI InChI=1S/C23H35NO2/c1-2-25-22-16-19-10-6-7-11-21(19)23(26-22)14-12-20(13-15-23)24-17-18-8-4-3-5-9-18/h6-7,10-11,18,20,22,24H,2-5,8-9,12-17H2,1H3/t20-,22?,23-
InChIKey LKSVIRCJQQMHGO-FXCIWXGGSA-N
Mol Weight 357.5 g/mol
Molecular Formula C23H35NO2
Exact Mass 357.266779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYBXJUNNC3F
Name trans-N-(Cyclohexylmethyl)-3-ethoxy-3,4-dihydrospiro[[2]benzopyran-1,1'-cyclohexan]-4'-amine
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35NO2
InChI InChI=1S/C23H35NO2/c1-2-25-22-16-19-10-6-7-11-21(19)23(26-22)14-12-20(13-15-23)24-17-18-8-4-3-5-9-18/h6-7,10-11,18,20,22,24H,2-5,8-9,12-17H2,1H3/t20-,22?,23-
InChIKey LKSVIRCJQQMHGO-FXCIWXGGSA-N
Instrument Name Thermo-Finnigan MAT GCQ
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.9b00449
Molecular Weight 357.538 g/mol
SMILES N([C@]1(CC[C@@]2(c3c(cccc3)CC(O2)OCC)CC1)[H])CC1CCCCC1
SPLASH splash10-0ff0-0920000000-aeca49ebb9737658a804
Source of Spectrum AF-62-SM9-7a
Thin-Layer Chromatography Rf = 0.21 (cyclohexane + 1% N, N-dimethylethanamine)
Wiley ID 1873904