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2-[(S)-(3-methoxyphenyl)-oxidanyl-methyl]prop-2-enamide

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

2-[(S)-(3-methoxyphenyl)-oxidanyl-methyl]prop-2-enamide
SpectraBase Compound ID 6N7R0YlHnnw
InChI InChI=1S/C11H13NO3/c1-7(11(12)14)10(13)8-4-3-5-9(6-8)15-2/h3-6,10,13H,1H2,2H3,(H2,12,14)/t10-/m1/s1
InChIKey BRWBANNWMNGOEA-SNVBAGLBSA-N
Mol Weight 207.23 g/mol
Molecular Formula C11H13NO3
Exact Mass 207.089543 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7eNo8Sro8WH
Name 2-[(S)-(3-Methoxyphenyl)-oxidanyl-methyl]prop-2-enamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 207.089543280 u
Formula C11H13NO3
InChI InChI=1S/C11H13NO3/c1-7(11(12)14)10(13)8-4-3-5-9(6-8)15-2/h3-6,10,13H,1H2,2H3,(H2,12,14)/t10-/m1/s1
InChIKey BRWBANNWMNGOEA-SNVBAGLBSA-N
Molecular Weight 207.229 g/mol
SMILES C(C([C@](C=1C=C(C=CC1)OC)(O)[H])=C)(=O)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.823159