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1-Hexadecyl-2-pentylbenzene

View entire compound with spectra: 1 MS (GC)

1-Hexadecyl-2-pentylbenzene
SpectraBase Compound ID AH0vPW3ncb4
InChI InChI=1S/C27H48/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-23-27-25-21-20-24-26(27)22-18-6-4-2/h20-21,24-25H,3-19,22-23H2,1-2H3
InChIKey DRROIWQFBMVSKZ-UHFFFAOYSA-N
Mol Weight 372.7 g/mol
Molecular Formula C27H48
Exact Mass 372.375602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aYAe14BHem
Name 1-Hexadecyl-2-pentylbenzene
Alternate Name(s) 1-Hexadecyl-2-pentyl-benzene
CAS Registry Number 72101-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48
InChI InChI=1S/C27H48/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-23-27-25-21-20-24-26(27)22-18-6-4-2/h20-21,24-25H,3-19,22-23H2,1-2H3
InChIKey DRROIWQFBMVSKZ-UHFFFAOYSA-N
Molecular Weight 372.681 g/mol
SMILES c1(c(CCCCCCCCCCCCCCCC)cccc1)CCCCC
SPLASH splash10-06xx-7902000000-4f8dac497b05369b464d
Source of Spectrum AA-0-2097-1
Wiley ID 54664