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6-Bromo-3-(4-ethoxyphenylimino)-methyl-1,3-dihydroindol-2-one
SpectraBase Compound ID DTj9mdlVdRC
InChI InChI=1S/C17H15BrN2O2/c1-3-22-12-6-4-11(5-7-12)19-16-13-8-10(2)14(18)9-15(13)20-17(16)21/h4-9H,3H2,1-2H3,(H,19,20,21)
InChIKey NLUXVNOLILKVSY-UHFFFAOYSA-N
Mol Weight 359.22 g/mol
Molecular Formula C17H15BrN2O2
Exact Mass 358.031691 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 94riQWD6C7p
Name 6-Bromo-3-(4-ethoxyphenylimino)-methyl-1,3-dihydroindol-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.031690729 u
Formula C17H15BrN2O2
InChI InChI=1S/C17H15BrN2O2/c1-3-22-12-6-4-11(5-7-12)19-16-13-8-10(2)14(18)9-15(13)20-17(16)21/h4-9H,3H2,1-2H3,(H,19,20,21)
InChIKey NLUXVNOLILKVSY-UHFFFAOYSA-N
Molecular Weight 359.223 g/mol
SMILES C1(=CC=C(C=C1)OCC)\N=C/1C(NC2=CC(=C(C)C=C12)Br)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930096