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4-Tert-butyl-1-butyl-2,7-dihydro-1H-azepine

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

4-Tert-butyl-1-butyl-2,7-dihydro-1H-azepine
SpectraBase Compound ID EbalZo0PwyI
InChI InChI=1S/C14H25N/c1-5-6-10-15-11-7-8-13(9-12-15)14(2,3)4/h7-9H,5-6,10-12H2,1-4H3
InChIKey RHUHICVMZFQUSL-UHFFFAOYSA-N
Mol Weight 207.36 g/mol
Molecular Formula C14H25N
Exact Mass 207.1987 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F4Z5q56jGUZ
Name 4-Tert-butyl-1-butyl-2,7-dihydro-1H-azepine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 207.198699809 u
Formula C14H25N
InChI InChI=1S/C14H25N/c1-5-6-10-15-11-7-8-13(9-12-15)14(2,3)4/h7-9H,5-6,10-12H2,1-4H3
InChIKey RHUHICVMZFQUSL-UHFFFAOYSA-N
Molecular Weight 207.361 g/mol
SMILES C1N(CC=CC(=C1)C(C)(C)C)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944393