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2H-1,3,4-Oxadiazin-2-one, 3,6-dihydro-5,6-dimethyl-6-(2-phenylethyl)-

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

2H-1,3,4-Oxadiazin-2-one, 3,6-dihydro-5,6-dimethyl-6-(2-phenylethyl)-
SpectraBase Compound ID 9NuXK8Rdwk6
InChI InChI=1S/C13H16N2O2/c1-10-13(2,17-12(16)15-14-10)9-8-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,15,16)
InChIKey XQPUETWVLCRNFJ-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C13H16N2O2
Exact Mass 232.121178 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KC4mTcPLPo1
Name 2H-1,3,4-Oxadiazin-2-one, 3,6-dihydro-5,6-dimethyl-6-(2-phenylethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.121177761 u
Formula C13H16N2O2
InChI InChI=1S/C13H16N2O2/c1-10-13(2,17-12(16)15-14-10)9-8-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,15,16)
InChIKey XQPUETWVLCRNFJ-UHFFFAOYSA-N
Molecular Weight 232.283 g/mol
SMILES C1=CC=C(C=C1)CCC1(OC(NN=C1C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.832663