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2,3,6-Trimethyl-5-phenyl-1,3-dihydro-1,2,4-triazin-6-ol

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

2,3,6-Trimethyl-5-phenyl-1,3-dihydro-1,2,4-triazin-6-ol
SpectraBase Compound ID LCYGFweGVKp
InChI InChI=1S/C12H17N3O/c1-9-13-11(10-7-5-4-6-8-10)12(2,16)14-15(9)3/h4-9,14,16H,1-3H3
InChIKey JBZVARFFRZOKGN-UHFFFAOYSA-N
Mol Weight 219.29 g/mol
Molecular Formula C12H17N3O
Exact Mass 219.137162 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Lh6JkX2KkZq
Name 2,3,6-Trimethyl-5-phenyl-1,3-dihydro-1,2,4-triazin-6-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.137162178 u
Formula C12H17N3O
InChI InChI=1S/C12H17N3O/c1-9-13-11(10-7-5-4-6-8-10)12(2,16)14-15(9)3/h4-9,14,16H,1-3H3
InChIKey JBZVARFFRZOKGN-UHFFFAOYSA-N
Molecular Weight 219.288 g/mol
SMILES C1(=NC(N(NC1(O)C)C)C)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903914