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Pyridate
SpectraBase Compound ID 6Sfvy3yBsJz
InChI InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3
InChIKey JTZCTMAVMHRNTR-UHFFFAOYSA-N
Mol Weight 378.92 g/mol
Molecular Formula C19H23ClN2O2S
Exact Mass 378.116877 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKFc5EOQwb2
Name Pyridate
CAS Registry Number 55512-33-9
Classification Herbicide
Copyright Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 378.116876861 u
Formula C19H23ClN2O2S
InChI InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3
InChIKey JTZCTMAVMHRNTR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 378.918 g/mol
SMILES c1cccc(-c2c(OC(=O)SCCCCCCCC)cc(Cl)nn2)c1
SPLASH splash10-0a4i-7390000000-2ac7ab39cb3dca54e4a0
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3864
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