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(2R,3S,4S)-2-(4-Chlorophenyl)-4-indolyl-3-nitrochroman
SpectraBase Compound ID 6Bj7z0567kJ
InChI InChI=1S/C23H17ClN2O3/c24-16-10-8-14(9-11-16)20-13-18-17(5-3-6-19(18)25-20)23-21(26(27)28)12-15-4-1-2-7-22(15)29-23/h1-11,13,21,23,25H,12H2/t21-,23+/m0/s1
InChIKey JORGABUTNAIAJT-JTHBVZDNSA-N
Mol Weight 404.85 g/mol
Molecular Formula C23H17ClN2O3
Exact Mass 404.09277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhKABDvjsSq
Name (2R,3S,4S)-2-(4-Chlorophenyl)-4-indolyl-3-nitrochroman
Alternate Name(s) 2-(4-Chlorophenyl)-4-[(2R,3S)-3-nitro-3,4-dihydro-2H-chromen-2-yl]-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17ClN2O3
InChI InChI=1S/C23H17ClN2O3/c24-16-10-8-14(9-11-16)20-13-18-17(5-3-6-19(18)25-20)23-21(26(27)28)12-15-4-1-2-7-22(15)29-23/h1-11,13,21,23,25H,12H2/t21-,23+/m0/s1
InChIKey JORGABUTNAIAJT-JTHBVZDNSA-N
Molecular Weight 404.853 g/mol
SMILES [nH]1c(cc2c1cccc2[C@@]1([C@@](N(=O)=O)(Cc2c(cccc2)O1)[H])[H])-c1ccc(cc1)Cl
SPLASH splash10-0596-0192300000-1e1cbcbe9b7a984a768e
Source of Spectrum KC-61-11756-18
Wiley ID 1631585