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Bis (4-methoxyindol-3-yl)methylium Trichloroacetate
SpectraBase Compound ID 4PSpQA18CHb
InChI InChI=1S/C19H17N2O2.C2HCl3O2/c1-22-16-7-3-5-14-18(16)12(10-20-14)9-13-11-21-15-6-4-8-17(23-2)19(13)15;3-2(4,5)1(6)7/h3-11,20-21H,1-2H3;(H,6,7)/q+1;/p-1
InChIKey GFXBJDAIZRRATH-UHFFFAOYSA-M
Mol Weight 467.74 g/mol
Molecular Formula C21H17Cl3N2O4
Exact Mass 466.02539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fUwFZPt2Mv
Name Bis (4-methoxyindol-3-yl)methylium Trichloroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17Cl3N2O4
InChI InChI=1S/C19H17N2O2.C2HCl3O2/c1-22-16-7-3-5-14-18(16)12(10-20-14)9-13-11-21-15-6-4-8-17(23-2)19(13)15;3-2(4,5)1(6)7/h3-11,20-21H,1-2H3;(H,6,7)/q+1;/p-1
InChIKey GFXBJDAIZRRATH-UHFFFAOYSA-M
Molecular Weight 467.736 g/mol
SMILES C(C([O-])=O)(Cl)(Cl)Cl.[nH]1c2c(c([CH+]c3c[nH]c4c3c(ccc4)OC)c1)c(ccc2)OC
SPLASH splash10-000t-0900000000-ad289ac031a988504cd3
Source of Spectrum AH-121-79-3
Synonyms 2,2,2-trichloroacetate; bis(4-methoxy-1H-indol-3-yl)methylium
Wiley ID 1391869