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Tert-butyl 3-(trifluoromethyl)piperazine-1-carboxylate

View entire compound with spectra: 1 FTIR

Tert-butyl 3-(trifluoromethyl)piperazine-1-carboxylate
SpectraBase Compound ID 9bNZbEskLNz
InChI InChI=1S/C10H17F3N2O2/c1-9(2,3)17-8(16)15-5-4-14-7(6-15)10(11,12)13/h7,14H,4-6H2,1-3H3
InChIKey WCGKHZHOGLVVPU-UHFFFAOYSA-N
Mol Weight 254.25 g/mol
Molecular Formula C10H17F3N2O2
Exact Mass 254.124212 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7vWkZBFpUSv
Name Tert-butyl 3-(trifluoromethyl)piperazine-1-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.124212282 u
Formula C10H17F3N2O2
InChI InChI=1S/C10H17F3N2O2/c1-9(2,3)17-8(16)15-5-4-14-7(6-15)10(11,12)13/h7,14H,4-6H2,1-3H3
InChIKey WCGKHZHOGLVVPU-UHFFFAOYSA-N
Molecular Weight 254.253 g/mol
SMILES C(F)(F)(F)C1NCCN(C1)C(=O)OC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.807964