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1-[4-(Chloro-difluoro-methoxy)-phenyl]-3-methyl-thiourea

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

1-[4-(Chloro-difluoro-methoxy)-phenyl]-3-methyl-thiourea
SpectraBase Compound ID CfnY1lq2H4S
InChI InChI=1S/C9H9ClF2N2OS/c1-13-8(16)14-6-2-4-7(5-3-6)15-9(10,11)12/h2-5H,1H3,(H2,13,14,16)
InChIKey QTTUEFIVEZGTAW-UHFFFAOYSA-N
Mol Weight 266.69 g/mol
Molecular Formula C9H9ClF2N2OS
Exact Mass 266.009218 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IoZYolho9mZ
Name 1-[4-(Chloro-difluoro-methoxy)-phenyl]-3-methyl-thiourea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.009218117 u
Formula C9H9ClF2N2OS
InChI InChI=1S/C9H9ClF2N2OS/c1-13-8(16)14-6-2-4-7(5-3-6)15-9(10,11)12/h2-5H,1H3,(H2,13,14,16)
InChIKey QTTUEFIVEZGTAW-UHFFFAOYSA-N
Molecular Weight 266.694 g/mol
SMILES C(OC=1C=CC(NC(=S)NC)=CC1)(Cl)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.901106