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2(1H)-Pyridone, 4-hydroxy-1,6-dimethyl-, acetate (ester)

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

2(1H)-Pyridone, 4-hydroxy-1,6-dimethyl-, acetate (ester)
SpectraBase Compound ID 7gctL6Oocr1
InChI InChI=1S/C9H11NO3/c1-6-4-8(13-7(2)11)5-9(12)10(6)3/h4-5H,1-3H3
InChIKey NIHLRIUJTFZUME-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4O70tGs4jec
Name 2(1H)-Pyridone, 4-hydroxy-1,6-dimethyl-, acetate (ester)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 181.073893215 u
Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c1-6-4-8(13-7(2)11)5-9(12)10(6)3/h4-5H,1-3H3
InChIKey NIHLRIUJTFZUME-UHFFFAOYSA-N
Molecular Weight 181.191 g/mol
SMILES C(OC=1C=C(C)N(C(C1)=O)C)(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.884683