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1-Isopropyl-2-(4-methoxybenzoyl)-aziridine
SpectraBase Compound ID 9qo8dJhpdUN
InChI InChI=1S/C13H17NO2/c1-9(2)14-8-12(14)13(15)10-4-6-11(16-3)7-5-10/h4-7,9,12H,8H2,1-3H3
InChIKey GYIZSLKWTBOTIQ-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 66u97I9yJHO
Name 1-Isopropyl-2-(4-methoxybenzoyl)-aziridine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.125928789 u
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-9(2)14-8-12(14)13(15)10-4-6-11(16-3)7-5-10/h4-7,9,12H,8H2,1-3H3
InChIKey GYIZSLKWTBOTIQ-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES C(=O)(C1CN1C(C)C)C1=CC=C(C=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970153