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10-Benzyl-3-benzyloxy-1-hydroxy-10H-acridin-9-one

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

10-Benzyl-3-benzyloxy-1-hydroxy-10H-acridin-9-one
SpectraBase Compound ID JmoWRBC7EsP
InChI InChI=1S/C27H21NO3/c29-25-16-21(31-18-20-11-5-2-6-12-20)15-24-26(25)27(30)22-13-7-8-14-23(22)28(24)17-19-9-3-1-4-10-19/h1-16,29H,17-18H2
InChIKey AJESRQHEPGDLMN-UHFFFAOYSA-N
Mol Weight 407.47 g/mol
Molecular Formula C27H21NO3
Exact Mass 407.152144 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KC5anqdKo5L
Name 10-Benzyl-3-benzyloxy-1-hydroxy-10H-acridin-9-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.152143537 u
Formula C27H21NO3
InChI InChI=1S/C27H21NO3/c29-25-16-21(31-18-20-11-5-2-6-12-20)15-24-26(25)27(30)22-13-7-8-14-23(22)28(24)17-19-9-3-1-4-10-19/h1-16,29H,17-18H2
InChIKey AJESRQHEPGDLMN-UHFFFAOYSA-N
Molecular Weight 407.469 g/mol
SMILES C=12N(C3=C(C(C2=C(O)C=C(C1)OCC=1C=CC=CC1)=O)C=CC=C3)CC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.866878