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Amyl ortho toluate

View entire compound with spectra: 2 MS (GC)

Amyl ortho toluate
SpectraBase Compound ID FbwWOY4v4P0
InChI InChI=1S/C13H18O2/c1-3-4-7-10-15-13(14)12-9-6-5-8-11(12)2/h5-6,8-9H,3-4,7,10H2,1-2H3
InChIKey YMAHRBGBVUOIMQ-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5jqJQHq34aw
Name Amyl ortho toluate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-4-7-10-15-13(14)12-9-6-5-8-11(12)2/h5-6,8-9H,3-4,7,10H2,1-2H3
InChIKey YMAHRBGBVUOIMQ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 206.285 g/mol
SMILES CCCCCOC(=O)c1ccccc1C
SPLASH splash10-014u-5900000000-77c7f24d7524894176d6
Source of Spectrum SRH-2022-57-0
Synonyms ortho-Toluic acid amyl ester
Wiley ID 1822600