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2-Methyl-3-acetyl-5-(2-triethylammoniumacetanilido)pyrrole bromide
SpectraBase Compound ID 6koPNrzkllk
InChI InChI=1S/C21H29N3O2.BrH/c1-6-24(7-2,8-3)14-21(26)23-19-12-10-9-11-17(19)20-13-18(16(5)25)15(4)22-20;/h9-13H,6-8,14H2,1-5H3,(H-,22,23,25,26);1H
InChIKey YCEUEACLGPUIOJ-UHFFFAOYSA-N
Mol Weight 436.39 g/mol
Molecular Formula C21H30BrN3O2
Exact Mass 435.15214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E5DvXi8XFeU
Name 2-Methyl-3-acetyl-5-(2-triethylammoniumacetanilido)pyrrole bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30BrN3O2
InChI InChI=1S/C21H29N3O2.BrH/c1-6-24(7-2,8-3)14-21(26)23-19-12-10-9-11-17(19)20-13-18(16(5)25)15(4)22-20;/h9-13H,6-8,14H2,1-5H3,(H-,22,23,25,26);1H
InChIKey YCEUEACLGPUIOJ-UHFFFAOYSA-N
Molecular Weight 436.394 g/mol
SMILES [Br-].[nH]1c(c(cc1-c1c(cccc1)NC(C[N+](CC)(CC)CC)=O)C(=O)C)C
SPLASH splash10-000i-9010000000-8bc1f9ae2c195796daa0
Source of Spectrum Y-17-702-0
Wiley ID 1383222