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3,5,7-tritert-butyl-4H-1,2-diazepine

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

3,5,7-tritert-butyl-4H-1,2-diazepine
SpectraBase Compound ID LRfY1UkCZsD
InChI InChI=1S/C17H30N2/c1-15(2,3)12-10-13(16(4,5)6)18-19-14(11-12)17(7,8)9/h10H,11H2,1-9H3
InChIKey GSCPOXPKRNIROV-UHFFFAOYSA-N
Mol Weight 262.44 g/mol
Molecular Formula C17H30N2
Exact Mass 262.240899 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BLz1Ra1XW3L
Name 3,5,7-Tritert-butyl-4H-1,2-diazepine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.240898974 u
Formula C17H30N2
InChI InChI=1S/C17H30N2/c1-15(2,3)12-10-13(16(4,5)6)18-19-14(11-12)17(7,8)9/h10H,11H2,1-9H3
InChIKey GSCPOXPKRNIROV-UHFFFAOYSA-N
Molecular Weight 262.441 g/mol
SMILES C1(=NN=C(C=C(C1)C(C)(C)C)C(C)(C)C)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951151