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1,3-Di-tert-butylbenzene
SpectraBase Compound ID 1BPVMxjOcJh
InChI InChI=1S/C14H22/c1-13(2,3)11-8-7-9-12(10-11)14(4,5)6/h7-10H,1-6H3
InChIKey ILNDSSCEZZFNGE-UHFFFAOYSA-N
Mol Weight 190.33 g/mol
Molecular Formula C14H22
Exact Mass 190.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnJx58LOMt6
Name 1,3-Di-tert-butylbenzene
CAS Registry Number 1014-60-4
Classification Antioxidant
Comments Spectrum verified by crosschecking against external libraries (two 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 190.172150708 u
Formula C14H22
InChI InChI=1S/C14H22/c1-13(2,3)11-8-7-9-12(10-11)14(4,5)6/h7-10H,1-6H3
InChIKey ILNDSSCEZZFNGE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 190.330 g/mol
Nominal Mass 190 u
Quality 979
Retention Index 1386
SMILES C(C=1C=CC=C(C(C)(C)C)C1)(C)(C)C
SPLASH splash10-004i-4900000000-c06ccd6c444547dd2b4d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms m-Di-tert-butylbenzene
Technique GC/MS
Wiley ID DD2024_032459