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4a-Methyl-10-phenyl-3,4,4a,10-tetrahydro-1,9a,10-triaza-anthracene-2,9-dione
SpectraBase Compound ID 1IiIXxLbMVE
InChI InChI=1S/C18H17N3O2/c1-18-12-11-16(22)19-21(18)17(23)14-9-5-6-10-15(14)20(18)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,19,22)
InChIKey OVZFIAVWBKPSJE-UHFFFAOYSA-N
Mol Weight 307.35 g/mol
Molecular Formula C18H17N3O2
Exact Mass 307.132077 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FRVyeiaA0SN
Name 4A-Methyl-10-phenyl-3,4,4A,10-tetrahydro-1,9A,10-triaza-anthracene-2,9-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.132076797 u
Formula C18H17N3O2
InChI InChI=1S/C18H17N3O2/c1-18-12-11-16(22)19-21(18)17(23)14-9-5-6-10-15(14)20(18)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,19,22)
InChIKey OVZFIAVWBKPSJE-UHFFFAOYSA-N
Molecular Weight 307.353 g/mol
SMILES C12(N(C(C3=C(N2C2=CC=CC=C2)C=CC=C3)=O)NC(CC1)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927827