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1,1,1-Trichloro-4-[2'-(3"-indolyl)ethylamino]-3-buten-2-one
SpectraBase Compound ID 61ve8P9dXpu
InChI InChI=1S/C14H13Cl3N2O/c15-14(16,17)13(20)6-8-18-7-5-10-9-19-12-4-2-1-3-11(10)12/h1-4,6,8-9,18-19H,5,7H2/b8-6+
InChIKey GQJIQYXWUOTQRS-SOFGYWHQSA-N
Mol Weight 331.63 g/mol
Molecular Formula C14H13Cl3N2O
Exact Mass 330.009346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GhKrIj9r64
Name 1,1,1-Trichloro-4-[2'-(3"-indolyl)ethylamino]-3-buten-2-one
Alternate Name(s) (3E)-1,1,1-trichloro-4-{[2-(1H-indol-3-yl)ethyl]amino}-3-buten-2-one 1,1,1-Trichloro-4-[2'-(3''-indolyl)ethylamino]-3-buten-2-one
CAS Registry Number 142656-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13Cl3N2O
InChI InChI=1S/C14H13Cl3N2O/c15-14(16,17)13(20)6-8-18-7-5-10-9-19-12-4-2-1-3-11(10)12/h1-4,6,8-9,18-19H,5,7H2/b8-6+
InChIKey GQJIQYXWUOTQRS-SOFGYWHQSA-N
Molecular Weight 331.630 g/mol
SMILES N(\C=C\C(C(Cl)(Cl)Cl)=O)CCc1c[nH]c2c1cccc2
SPLASH splash10-001i-0900000000-ac22e3f228eebab596e4
Source of Spectrum U-1992-1064-4
Wiley ID 764525