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PENDIMETHALIN;N-(1-ETHYLPROPYL)-3,4-DIMETHYL-2,6-DINITROBENZENAMINE
SpectraBase Compound ID 6PdUo8QjunG
InChI InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3
InChIKey CHIFOSRWCNZCFN-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C13H19N3O4
Exact Mass 281.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMu2Jz6GBJQ
Name Penoxalin
CAS Registry Number 40487-42-1
Classification Herbicide
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 281.137556100 u
Formula C13H19N3O4
InChI InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3
InChIKey CHIFOSRWCNZCFN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 281.312 g/mol
SMILES c1(N(=O)=O)c(c(c(c(c1)C)C)N(=O)=O)NC(CC)CC
SPLASH splash10-0zfr-9530000000-ac6c5155a02693e4550b
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_1221