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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 6Zinu5ISvo9
Name Nitrothal-isopropyl
Source of Sample Sigma-Aldrich Cat. #36179
CAS Registry Number 10552-74-6
Classification Pesticides: Fungicides
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
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
Number of Peaks 48
RI1 2001
SMILES c1c(cc(cc1C(=O)OC(C)C)C(=O)OC(C)C)N(=O)=O
SPLASH splash10-0006-9440000000-b3265b47be7841a6e2be
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,3-Benzenedicarboxylic acid, 5-nitro-, 1,3-bis(1-methylethyl) ester
Wiley ID LM_PEST_59