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1H-Azepine-1-carbothioic acid, hexahydro-, S-ethyl ester
SpectraBase Compound ID 69VhmEyqISV
InChI InChI=1S/C9H17NOS/c1-2-12-9(11)10-7-5-3-4-6-8-10/h2-8H2,1H3
InChIKey DEDOPGXGGQYYMW-UHFFFAOYSA-N
Mol Weight 187.3 g/mol
Molecular Formula C9H17NOS
Exact Mass 187.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9JxmylQ2DL4
Name Molinate
Source of Sample Sigma-Aldrich Cat. #36171
CAS Registry Number 2212-67-1
Classification Pesticides: Herbicides
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17NOS
InChI InChI=1S/C9H17NOS/c1-2-12-9(11)10-7-5-3-4-6-8-10/h2-8H2,1H3
InChIKey DEDOPGXGGQYYMW-UHFFFAOYSA-N
Number of Peaks 47
RI1 1532
SMILES CCSC(=O)N1CCCCCC1
SPLASH splash10-0a6r-9300000000-f84b70e69f7b09bf86f8
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1H-Azepine-1-carbothioic acid, hexahydro-, S-ethyl ester
Wiley ID LM_PEST_19