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Hex-2-yl-p-toluate
SpectraBase Compound ID BeS2HjdIPtZ
InChI InChI=1S/C14H20O2/c1-4-5-6-12(3)16-14(15)13-9-7-11(2)8-10-13/h7-10,12H,4-6H2,1-3H3
InChIKey NEQPOYDNBUNGBL-UHFFFAOYSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mQg35hWi24
Name Hex-2-yl-p-toluate
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 220.146329882 u
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-4-5-6-12(3)16-14(15)13-9-7-11(2)8-10-13/h7-10,12H,4-6H2,1-3H3
InChIKey NEQPOYDNBUNGBL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 220.312 g/mol
Nominal Mass 220 u
Quality 990
Retention Index 1590
SMILES C1(C(OC(CCCC)C)=O)=CC=C(C=C1)C
SPLASH splash10-014u-9700000000-5176c9af50cbeab9b213
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Hex-2-yl-4-methyl benzoate hexan-2-yl 4-methylbenzoate
Technique GC/MS
Wiley ID DD2024_010322