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1-Methyl-2-(phenylthiocarbonylimino)pyrrolidine

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

1-Methyl-2-(phenylthiocarbonylimino)pyrrolidine
SpectraBase Compound ID 9HnhPbDWHjg
InChI InChI=1S/C12H14N2S/c1-14-9-5-8-11(14)13-12(15)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3/b13-11-
InChIKey DJXPQLWMKJCHAH-QBFSEMIESA-N
Mol Weight 218.32 g/mol
Molecular Formula C12H14N2S
Exact Mass 218.08777 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1EnHPI4z793
Name 1-Methyl-2-(phenylthiocarbonylimino)pyrrolidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.087769633 u
Formula C12H14N2S
InChI InChI=1S/C12H14N2S/c1-14-9-5-8-11(14)13-12(15)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3/b13-11-
InChIKey DJXPQLWMKJCHAH-QBFSEMIESA-N
Molecular Weight 218.318 g/mol
SMILES C1N(\C(=N/C(=S)C2=CC=CC=C2)CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.881922