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3-(3,5-Dimethyl-2-hydroxybenzyl)-5-methyl-1,3,5-oxadiazolidin-4-one

View entire compound with spectra: 1 FTIR, and 1 Raman

3-(3,5-Dimethyl-2-hydroxybenzyl)-5-methyl-1,3,5-oxadiazolidin-4-one
SpectraBase Compound ID Ib9THeiAlYp
InChI InChI=1S/C13H18N2O3/c1-9-4-10(2)12(16)11(5-9)6-15-8-18-7-14(3)13(15)17/h4-5,16H,6-8H2,1-3H3
InChIKey NPCZIEGGCHWELA-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C13H18N2O3
Exact Mass 250.131742 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID CIoHGw3mpo9
Name 3-(3,5-Dimethyl-2-hydroxybenzyl)-5-methyl-1,3,5-oxadiazolidin-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.131742445 u
Formula C13H18N2O3
InChI InChI=1S/C13H18N2O3/c1-9-4-10(2)12(16)11(5-9)6-15-8-18-7-14(3)13(15)17/h4-5,16H,6-8H2,1-3H3
InChIKey NPCZIEGGCHWELA-UHFFFAOYSA-N
Molecular Weight 250.298 g/mol
SMILES OC1=C(CN2C(N(C)COC2)=O)C=C(C)C=C1C
Spectrum/Structure Validation Score (Raman) 0.778377