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4-Tert-octylphenol
SpectraBase Compound ID 2fnEkAPcjzj
InChI InChI=1S/C14H22O/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11/h6-9,15H,10H2,1-5H3
InChIKey ISAVYTVYFVQUDY-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEew2mrIKtU
Name 4-(1,1,3,3-tetramethylbutyl)phenol
CAS Registry Number 37769-53-2
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 206.167065327 u
Formula C14H22O
InChI InChI=1S/C14H22O/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11/h6-9,15H,10H2,1-5H3
InChIKey ISAVYTVYFVQUDY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 206.329 g/mol
Nominal Mass 206 u
Quality 899
Retention Index 1494
SMILES OC1=CC=C(C(CC(C)(C)C)(C)C)C=C1
SPLASH splash10-000i-3900000000-ad17c5914c371e3fcf0e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(1,1,3,3-Tetramethylbutyl)phenol 4-(2,4,4-trimethylpentan-2-yl)phenol
Technique GC/MS
Wiley ID DD2024_025607