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6-(Hydroxymethyl)-8-methoxy-2,4-dihydro-1,4-benzoxazin-3-one
SpectraBase Compound ID 2PUtKSTPCCt
InChI InChI=1S/C10H11NO4/c1-14-8-3-6(4-12)2-7-10(8)15-5-9(13)11-7/h2-3,12H,4-5H2,1H3,(H,11,13)
InChIKey AZUUIIRVDQKRJN-UHFFFAOYSA-N
Mol Weight 209.2 g/mol
Molecular Formula C10H11NO4
Exact Mass 209.068808 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8P2FTxmuUNf
Name 6-(Hydroxymethyl)-8-methoxy-2,4-dihydro-1,4-benzoxazin-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.068807834 u
Formula C10H11NO4
InChI InChI=1S/C10H11NO4/c1-14-8-3-6(4-12)2-7-10(8)15-5-9(13)11-7/h2-3,12H,4-5H2,1H3,(H,11,13)
InChIKey AZUUIIRVDQKRJN-UHFFFAOYSA-N
Molecular Weight 209.201 g/mol
SMILES C(C1=CC=2NC(COC2C(=C1)OC)=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954871