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1-(4-(tert-butyl)benzyl)naphthalene
SpectraBase Compound ID 8KAT6dYssw
InChI InChI=1S/C21H22/c1-21(2,3)19-13-11-16(12-14-19)15-18-9-6-8-17-7-4-5-10-20(17)18/h4-14H,15H2,1-3H3
InChIKey FMCWWKNYOQJHBZ-UHFFFAOYSA-N
Mol Weight 274.41 g/mol
Molecular Formula C21H22
Exact Mass 274.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jLC4ErT9D
Name 1-(4-(tert-butyl)benzyl)naphthalene
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.172150708 u
Formula C21H22
InChI InChI=1S/C21H22/c1-21(2,3)19-13-11-16(12-14-19)15-18-9-6-8-17-7-4-5-10-20(17)18/h4-14H,15H2,1-3H3
InChIKey FMCWWKNYOQJHBZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201701691
Molecular Weight 274.407 g/mol
Quality 93
SMILES C1=C(C=CC(=C1)CC1=CC=CC2=C1C=CC=C2)C(C)(C)C
SPLASH splash10-0a4l-0390000000-0ada1d6814a4535fd74b
Source of Spectrum ACI-56-SM18-6h (DOI: 10.1002/anie.201701691)
Thin-Layer Chromatography 0.52 (Hexane/EtOAc, 40:1)
Wiley ID 1896009