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Ethyl N-(6-fluoranyl-2-oxidanylidene-3H-benzimidazol-1-yl)carbamate

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

Ethyl N-(6-fluoranyl-2-oxidanylidene-3H-benzimidazol-1-yl)carbamate
SpectraBase Compound ID JwCBDMWsbCK
InChI InChI=1S/C10H10FN3O3/c1-2-17-10(16)13-14-8-5-6(11)3-4-7(8)12-9(14)15/h3-5H,2H2,1H3,(H,12,15)(H,13,16)
InChIKey OREXZAINXFCKQB-UHFFFAOYSA-N
Mol Weight 239.21 g/mol
Molecular Formula C10H10FN3O3
Exact Mass 239.070619 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IPDDEPmk9da
Name Ethyl N-(6-fluoranyl-2-oxidanylidene-3H-benzimidazol-1-yl)carbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.070619354 u
Formula C10H10FN3O3
InChI InChI=1S/C10H10FN3O3/c1-2-17-10(16)13-14-8-5-6(11)3-4-7(8)12-9(14)15/h3-5H,2H2,1H3,(H,12,15)(H,13,16)
InChIKey OREXZAINXFCKQB-UHFFFAOYSA-N
Molecular Weight 239.206 g/mol
SMILES C1(NC=2C(N1NC(=O)OCC)=CC(=CC2)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847028