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Hexyl salicylate
SpectraBase Compound ID 5NXpKT8FvYL
InChI InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3
InChIKey DUKPKQFHJQGTGU-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIs0fzWgM9g
Name Hexyl salicylate
CAS Registry Number 6259-76-3
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 222.125594437 u
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3
InChIKey DUKPKQFHJQGTGU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 222.284 g/mol
Nominal Mass 222 u
Quality 993
Retention Index 1600
SMILES OC1=C(C(OCCCCCC)=O)C=CC=C1
SPLASH splash10-00di-4900000000-57c975b64d9cf8a232ca
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Hexyl n-Hexyl salicylate Hexyl 2-hydroxy benzoate
Technique GC/MS
Wiley ID DD2024_028050