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1-[2-(diethylamino)ethyl]-3-(diphenylmethyl)-2(1H)-quinoxalinone
SpectraBase Compound ID LqB7mxIj1Wr
InChI InChI=1S/C27H29N3O/c1-3-29(4-2)19-20-30-24-18-12-11-17-23(24)28-26(27(30)31)25(21-13-7-5-8-14-21)22-15-9-6-10-16-22/h5-18,25H,3-4,19-20H2,1-2H3
InChIKey XSVUUDVVSVQHPF-UHFFFAOYSA-N
Mol Weight 411.55 g/mol
Molecular Formula C27H29N3O
Exact Mass 411.231063 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FNEhBmcLI2J
Name 1-[2-(Diethylamino)ethyl]-3-(diphenylmethyl)-2(1H)-quinoxalinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.231062565 u
Formula C27H29N3O
InChI InChI=1S/C27H29N3O/c1-3-29(4-2)19-20-30-24-18-12-11-17-23(24)28-26(27(30)31)25(21-13-7-5-8-14-21)22-15-9-6-10-16-22/h5-18,25H,3-4,19-20H2,1-2H3
InChIKey XSVUUDVVSVQHPF-UHFFFAOYSA-N
Molecular Weight 411.549 g/mol
SMILES C=1C=CC(=CC1)C(C1=NC=2C=CC=CC2N(C1=O)CCN(CC)CC)C1=CC=CC=C1
Spectrum/Structure Validation Score (Raman) 0.990676