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3-Methoxy-4-hydroxy-methyl-nitrostyrene

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3-Methoxy-4-hydroxy-methyl-nitrostyrene
SpectraBase Compound ID E6FQwk9cpYg
InChI InChI=1S/C10H11NO4/c1-15-10-6-8(4-5-11(13)14)2-3-9(10)7-12/h2-6,12H,7H2,1H3/b5-4+
InChIKey WTPFTLSSHUTSCO-SNAWJCMRSA-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 CbzYf7lVtT4
Name 3-Methoxy-4-hydroxy-methyl-nitrostyrene
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/c1-15-10-6-8(4-5-11(13)14)2-3-9(10)7-12/h2-6,12H,7H2,1H3/b5-4+
InChIKey WTPFTLSSHUTSCO-SNAWJCMRSA-N
Molecular Weight 209.201 g/mol
SMILES C1(\C=C\N(=O)=O)=CC(=C(C=C1)CO)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.817668