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8,8'-Bis-5,11-Dimethyl-5,6,11,12-tetrahydro-2-methoxydibenzo[b,f][1,5]diazocine
SpectraBase Compound ID G3exNeiG47Z
InChI InChI=1S/C34H38N4O2/c1-35-19-25-15-23(7-11-31(25)37(3)21-27-17-29(39-5)9-13-33(27)35)24-8-12-32-26(16-24)20-36(2)34-14-10-30(40-6)18-28(34)22-38(32)4/h7-18H,19-22H2,1-6H3
InChIKey DWOSUBOWOJUFMH-UHFFFAOYSA-N
Mol Weight 534.7 g/mol
Molecular Formula C34H38N4O2
Exact Mass 534.299476 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 65oC1DedOf5
Name 8,8'-bis-5,11-Dimethyl-5,6,11,12-tetrahydro-2-methoxydibenzo[B,F][1,5]diazocine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 534.299476478 u
Formula C34H38N4O2
InChI InChI=1S/C34H38N4O2/c1-35-19-25-15-23(7-11-31(25)37(3)21-27-17-29(39-5)9-13-33(27)35)24-8-12-32-26(16-24)20-36(2)34-14-10-30(40-6)18-28(34)22-38(32)4/h7-18H,19-22H2,1-6H3
InChIKey DWOSUBOWOJUFMH-UHFFFAOYSA-N
Molecular Weight 534.704 g/mol
SMILES C12=C(N(CC3=C(N(C2)C)C=CC(=C3)OC)C)C=CC(C2=CC=3CN(C=4C=CC(=CC4CN(C3C=C2)C)OC)C)=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904017