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Methyl 6-[(t-butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylate

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

Methyl 6-[(t-butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylate
SpectraBase Compound ID 8RiBZs2DkY6
InChI InChI=1S/C13H21NO4/c1-13(2,3)18-12(16)14-10-8-6-5-7-9(10)11(15)17-4/h5-6,9-10H,7-8H2,1-4H3,(H,14,16)
InChIKey RZIDCDXFSTUXMB-UHFFFAOYSA-N
Mol Weight 255.31 g/mol
Molecular Formula C13H21NO4
Exact Mass 255.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B8dekze9qDJ
Name Methyl 6-[(T-butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.147058156 u
Formula C13H21NO4
InChI InChI=1S/C13H21NO4/c1-13(2,3)18-12(16)14-10-8-6-5-7-9(10)11(15)17-4/h5-6,9-10H,7-8H2,1-4H3,(H,14,16)
InChIKey RZIDCDXFSTUXMB-UHFFFAOYSA-N
Molecular Weight 255.314 g/mol
SMILES C1(CC=CCC1NC(=O)OC(C)(C)C)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903648