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1,3-bis(1,1-Dioxo-1-thiolan-3-yl)thiourea

View entire compound with spectra: 1 FTIR

1,3-bis(1,1-Dioxo-1-thiolan-3-yl)thiourea
SpectraBase Compound ID JtbesJcM5DV
InChI InChI=1S/C9H16N2O4S3/c12-17(13)3-1-7(5-17)10-9(16)11-8-2-4-18(14,15)6-8/h7-8H,1-6H2,(H2,10,11,16)
InChIKey XEFICVPSYOOJMW-UHFFFAOYSA-N
Mol Weight 312.42 g/mol
Molecular Formula C9H16N2O4S3
Exact Mass 312.027221 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5IBNWxgYxCn
Name 1,3-bis(1,1-Dioxo-1-thiolan-3-yl)thiourea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.027220521 u
Formula C9H16N2O4S3
InChI InChI=1S/C9H16N2O4S3/c12-17(13)3-1-7(5-17)10-9(16)11-8-2-4-18(14,15)6-8/h7-8H,1-6H2,(H2,10,11,16)
InChIKey XEFICVPSYOOJMW-UHFFFAOYSA-N
Molecular Weight 312.417 g/mol
SMILES C1CC(NC(=S)NC2CCS(C2)(=O)=O)CS1(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937232