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Phenmetrazine, 2,2,2-trichloroethyl carbamate

View entire compound with spectra: 1 FTIR

Phenmetrazine, 2,2,2-trichloroethyl carbamate
SpectraBase Compound ID 12E5SUTJAdZ
InChI InChI=1S/C14H16Cl3NO3/c1-10-12(11-5-3-2-4-6-11)20-8-7-18(10)13(19)21-9-14(15,16)17/h2-6,10,12H,7-9H2,1H3
InChIKey FGZTZMUTVDUKIX-UHFFFAOYSA-N
Mol Weight 352.65 g/mol
Molecular Formula C14H16Cl3NO3
Exact Mass 351.019576 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6gHZBq8zIJi
Name Phenmetrazine, 2,2,2-trichloroethyl carbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.019576476 u
Formula C14H16Cl3NO3
InChI InChI=1S/C14H16Cl3NO3/c1-10-12(11-5-3-2-4-6-11)20-8-7-18(10)13(19)21-9-14(15,16)17/h2-6,10,12H,7-9H2,1H3
InChIKey FGZTZMUTVDUKIX-UHFFFAOYSA-N
Molecular Weight 352.645 g/mol
SMILES C1=CC=C(C=C1)C1C(N(C(OCC(Cl)(Cl)Cl)=O)CCO1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.835317