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9-Dodecyl-dodecahydro-2H-1,8a-diazaphenanthrene

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

9-Dodecyl-dodecahydro-2H-1,8a-diazaphenanthrene
SpectraBase Compound ID EsI01PZg0Fe
InChI InChI=1S/C24H46N2/c1-2-3-4-5-6-7-8-9-10-11-15-21-20-23-22(16-14-18-25-23)24-17-12-13-19-26(21)24/h21-25H,2-20H2,1H3
InChIKey RAJSPJXPRMUTMI-UHFFFAOYSA-N
Mol Weight 362.6 g/mol
Molecular Formula C24H46N2
Exact Mass 362.366099 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K1IkvBM3nT1
Name 9-Dodecyl-dodecahydro-2H-1,8A-diazaphenanthrene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.366099489 u
Formula C24H46N2
InChI InChI=1S/C24H46N2/c1-2-3-4-5-6-7-8-9-10-11-15-21-20-23-22(16-14-18-25-23)24-17-12-13-19-26(21)24/h21-25H,2-20H2,1H3
InChIKey RAJSPJXPRMUTMI-UHFFFAOYSA-N
Molecular Weight 362.646 g/mol
SMILES C12N(C(CC3NCCCC23)CCCCCCCCCCCC)CCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91489