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anhranilic acid, cyclohexyl ester
SpectraBase Compound ID Fwa6qvzQqNt
InChI InChI=1S/C13H17NO2/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7,14H2
InChIKey KFEZETDKFSMLMG-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KBF0csdluI
Name Cyclohexyl anthranilate
CAS Registry Number 7779-16-0
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 219.125928789 u
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7,14H2
InChIKey KFEZETDKFSMLMG-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
Number of Peaks 50
RI1 1895
RI2 1570
SMILES Nc1ccccc1C(OC1CCCCC1)=O
SPLASH splash10-014r-3900000000-6cdd1cd07bc1bf02dc56
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzoic acid, 2-amino-, cyclohexyl ester
Wiley ID LM_FFNSC3_1215