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1,3-Dimethyl-5-tridecylbenzene
SpectraBase Compound ID 4xhqoH03kLW
InChI InChI=1S/C21H36/c1-4-5-6-7-8-9-10-11-12-13-14-15-21-17-19(2)16-20(3)18-21/h16-18H,4-15H2,1-3H3
InChIKey BTOHGMFFBICTHQ-UHFFFAOYSA-N
Mol Weight 288.5 g/mol
Molecular Formula C21H36
Exact Mass 288.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3N36rRk9CSF
Name 1,3-Dimethyl-5-tridecylbenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36
InChI InChI=1S/C21H36/c1-4-5-6-7-8-9-10-11-12-13-14-15-21-17-19(2)16-20(3)18-21/h16-18H,4-15H2,1-3H3
InChIKey BTOHGMFFBICTHQ-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890-5793N or Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202003392
Molecular Weight 288.519 g/mol
Reported Formula C21H36
SMILES c1(cc(cc(c1)C)CCCCCCCCCCCCC)C
SPLASH splash10-0600-0900000000-faa95d5b87a74c42bc51
Source of Spectrum ACI-59-SM39-11cm
Wiley ID 1858115