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1-Benzoyl-2-(methoxymethyl)-2,3-dihydropyrrole

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

1-Benzoyl-2-(methoxymethyl)-2,3-dihydropyrrole
SpectraBase Compound ID 1EXnvChrMtc
InChI InChI=1S/C13H15NO2/c1-16-10-12-8-5-9-14(12)13(15)11-6-3-2-4-7-11/h2-7,9,12H,8,10H2,1H3
InChIKey QIIDTDLFCVEFQD-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 69HJOJTmA5I
Name 1-Benzoyl-2-(methoxymethyl)-2,3-dihydropyrrole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 217.110278725 u
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-16-10-12-8-5-9-14(12)13(15)11-6-3-2-4-7-11/h2-7,9,12H,8,10H2,1H3
InChIKey QIIDTDLFCVEFQD-UHFFFAOYSA-N
Molecular Weight 217.268 g/mol
SMILES C(N1C=CCC1COC)(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894374