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cis-Siduron
SpectraBase Compound ID 70z7vSTBHgc
InChI InChI=1S/C14H20N2O/c1-11-7-5-6-10-13(11)16-14(17)15-12-8-3-2-4-9-12/h2-4,8-9,11,13H,5-7,10H2,1H3,(H2,15,16,17)/t11-,13+/m0/s1
InChIKey JXVIIQLNUPXOII-WCQYABFASA-N
Mol Weight 232.33 g/mol
Molecular Formula C14H20N2O
Exact Mass 232.157563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhASECyFBin
Name cis-Siduron
Source of Sample Sigma-Aldrich Cat. #34373
CAS Registry Number 19123-57-0
Classification Pesticides: Herbicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 232.157563271 u
Formula C14H20N2O
InChI InChI=1S/C14H20N2O/c1-11-7-5-6-10-13(11)16-14(17)15-12-8-3-2-4-9-12/h2-4,8-9,11,13H,5-7,10H2,1H3,(H2,15,16,17)/t11-,13+/m0/s1
InChIKey JXVIIQLNUPXOII-WCQYABFASA-N
Molecular Weight 232.327 g/mol
Number of Peaks 47
RI1 2135
SMILES N(C(=O)Nc1ccccc1)[C@]1([C@](CCCC1)(C)[H])[H]
SPLASH splash10-0006-9000000000-4df0d658ccf592221745
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Urea, N-[(1R,2S)-2-methylcyclohexyl]-N'-phenyl-, rel-
Wiley ID LM_PEST_633