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1-Aziridinepropanoic acid, 2-methyl-3-(1-methylethyl)-, ethyl ester, trans-

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

1-Aziridinepropanoic acid, 2-methyl-3-(1-methylethyl)-, ethyl ester, trans-
SpectraBase Compound ID BjjdAnEXwtg
InChI InChI=1S/C11H21NO2/c1-5-14-10(13)6-7-12-9(4)11(12)8(2)3/h8-9,11H,5-7H2,1-4H3
InChIKey NAHXRIWTDZRRSW-UHFFFAOYSA-N
Mol Weight 199.29 g/mol
Molecular Formula C11H21NO2
Exact Mass 199.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KpyG36HRmeV
Name 1-Aziridinepropanoic acid, 2-methyl-3-(1-methylethyl)-, ethyl ester, trans-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 199.157228918 u
Formula C11H21NO2
InChI InChI=1S/C11H21NO2/c1-5-14-10(13)6-7-12-9(4)11(12)8(2)3/h8-9,11H,5-7H2,1-4H3
InChIKey NAHXRIWTDZRRSW-UHFFFAOYSA-N
Molecular Weight 199.294 g/mol
SMILES C(CC(OCC)=O)N1C(C(C)C)C1C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.916674