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5-Heptadecyl-1,3-benzenediol
SpectraBase Compound ID 17GWavXniae
InChI InChI=1S/C23H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h18-20,24-25H,2-17H2,1H3
InChIKey BBGNINPPDHJETF-UHFFFAOYSA-N
Mol Weight 348.6 g/mol
Molecular Formula C23H40O2
Exact Mass 348.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56Y93ne2l5L
Name 5-Heptadecyl-1,3-benzenediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40O2
InChI InChI=1S/C23H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h18-20,24-25H,2-17H2,1H3
InChIKey BBGNINPPDHJETF-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890 N-Agilent Technologies 5975B
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202000811
Molecular Weight 348.571 g/mol
SMILES Oc1cc(cc(c1)O)CCCCCCCCCCCCCCCCC
SPLASH splash10-00di-1900000000-313812eab154516fc663
Source of Spectrum CBD-18-SM7-e2, Figure S9 (A)
Wiley ID 1856454