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1-(4-tert-butylphenyl)-2-pentadeuterophenylethane
SpectraBase Compound ID otz2I242Kq
InChI InChI=1S/C18H22/c1-18(2,3)17-13-11-16(12-14-17)10-9-15-7-5-4-6-8-15/h4-8,11-14H,9-10H2,1-3H3/i4D,5D,6D,7D,8D
InChIKey KFPRNBJQLRAVCX-UPKDRLQUSA-N
Mol Weight 243.4 g/mol
Molecular Formula C18H172D5
Exact Mass 243.203534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtXkFWfqKy8
Name 1-(4-tert-butylphenyl)-2-pentadeuterophenylethane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17D5
InChI InChI=1S/C18H22/c1-18(2,3)17-13-11-16(12-14-17)10-9-15-7-5-4-6-8-15/h4-8,11-14H,9-10H2,1-3H3/i4D,5D,6D,7D,8D
InChIKey KFPRNBJQLRAVCX-UPKDRLQUSA-N
Molecular Weight 243.405 g/mol
SMILES C(c1ccc(cc1)CCc1c(c([2D])c(c(c1[2D])[2D])[2D])[2D])(C)(C)C
SPLASH splash10-0002-3920000000-0fad3e7486fb2cb7e488
Source of Spectrum O-28-1073-0
Wiley ID 1241622