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Nitrothal-iso-propyl
SpectraBase Compound ID 3Y8Jlzh39MH
InChI InChI=1S/C14H17NO6/c1-8(2)20-13(16)10-5-11(14(17)21-9(3)4)7-12(6-10)15(18)19/h5-9H,1-4H3
InChIKey VJAWBEFMCIINFU-UHFFFAOYSA-N
Mol Weight 295.29 g/mol
Molecular Formula C14H17NO6
Exact Mass 295.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A85Jkv7zQko
Name Nitrothal-isopropyl
CAS Registry Number 10552-74-6
Classification Fungicide
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Exact Mass 295.105587265 u
Formula C14H17NO6
InChI InChI=1S/C14H17NO6/c1-8(2)20-13(16)10-5-11(14(17)21-9(3)4)7-12(6-10)15(18)19/h5-9H,1-4H3
InChIKey VJAWBEFMCIINFU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 295.291 g/mol
SMILES c1c(cc(cc1C(=O)OC(C)C)C(=O)OC(C)C)N(=O)=O
SPLASH splash10-01pc-3690000000-45680b8b77df070e884c
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_3455