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Thymol
SpectraBase Compound ID IaAqV9ikgfF
InChI InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3
InChIKey MGSRCZKZVOBKFT-UHFFFAOYSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JI1E0Tmahfc
Name Thymol
CAS Registry Number 89-83-8
Classification Disinfectant
Comments Spectrum verified by crosschecking against external libraries (three reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 150.104465070 u
Formula C10H14O
InChI InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3
InChIKey MGSRCZKZVOBKFT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 150.221 g/mol
Nominal Mass 150 u
Quality 802
Retention Index 1270
SMILES OC1=C(C(C)C)C=CC(=C1)C
SPLASH splash10-000i-4900000000-e3e80a171c57abb3e057
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-Isopropyl-5-methylphenol
Technique GC/MS
Wiley ID DD2024_029812