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Indolin-2-one, 3-butyl-1-methyl-3-t-butyl-

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

Indolin-2-one, 3-butyl-1-methyl-3-t-butyl-
SpectraBase Compound ID LSekzJEnBLT
InChI InChI=1S/C17H25NO/c1-6-7-12-17(16(2,3)4)13-10-8-9-11-14(13)18(5)15(17)19/h8-11H,6-7,12H2,1-5H3
InChIKey SZSDVHVEYHBPRO-UHFFFAOYSA-N
Mol Weight 259.39 g/mol
Molecular Formula C17H25NO
Exact Mass 259.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GUEa8xShDmb
Name Indolin-2-one, 3-butyl-1-methyl-3-T-butyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.193614428 u
Formula C17H25NO
InChI InChI=1S/C17H25NO/c1-6-7-12-17(16(2,3)4)13-10-8-9-11-14(13)18(5)15(17)19/h8-11H,6-7,12H2,1-5H3
InChIKey SZSDVHVEYHBPRO-UHFFFAOYSA-N
Molecular Weight 259.393 g/mol
SMILES CN1C(=O)C(C=2C1=CC=CC2)(CCCC)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.940429