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3-Benzyl-7a-methyldihydro-1-phenylamino-1H-pyrrolo[1,2-a]imidazole-2,5-(3H,6H)-dione
SpectraBase Compound ID AHZHqgyzZX1
InChI InChI=1S/C20H21N3O2/c1-20-13-12-18(24)22(20)17(14-15-8-4-2-5-9-15)19(25)23(20)21-16-10-6-3-7-11-16/h2-11,17,21H,12-14H2,1H3
InChIKey YTUBKLNWFBMNPA-UHFFFAOYSA-N
Mol Weight 335.41 g/mol
Molecular Formula C20H21N3O2
Exact Mass 335.163377 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hpg42p4pdHh
Name 3-Benzyl-7A-methyldihydro-1-phenylamino-1H-pyrrolo[1,2-A]imidazole-2,5-(3H,6H)-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.163376926 u
Formula C20H21N3O2
InChI InChI=1S/C20H21N3O2/c1-20-13-12-18(24)22(20)17(14-15-8-4-2-5-9-15)19(25)23(20)21-16-10-6-3-7-11-16/h2-11,17,21H,12-14H2,1H3
InChIKey YTUBKLNWFBMNPA-UHFFFAOYSA-N
Molecular Weight 335.407 g/mol
SMILES C12(N(C(C(N2C(=O)CC1)CC=1C=CC=CC1)=O)NC1=CC=CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964378