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Propisochlor

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

Propisochlor
SpectraBase Compound ID HnE5oPtrGp8
InChI InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-12(4)15(13)17(14(18)9-16)10-19-11(2)3/h6-8,11H,5,9-10H2,1-4H3
InChIKey KZNDFYDURHAESM-UHFFFAOYSA-N
Mol Weight 283.8 g/mol
Molecular Formula C15H22ClNO2
Exact Mass 283.133907 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hb1mG52hv1a
Name Propisochlor
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.133906650 u
Formula C15H22ClNO2
InChI InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-12(4)15(13)17(14(18)9-16)10-19-11(2)3/h6-8,11H,5,9-10H2,1-4H3
InChIKey KZNDFYDURHAESM-UHFFFAOYSA-N
Molecular Weight 283.799 g/mol
SMILES C1(N(C(CCl)=O)COC(C)C)=C(C=CC=C1C)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.911248