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2- phenoxypropane-1,3-diol
SpectraBase Compound ID BLzVARdVARw
InChI InChI=1S/C9H12O3/c10-6-9(7-11)12-8-4-2-1-3-5-8/h1-5,9-11H,6-7H2
InChIKey IEAGXQUAKGSSHK-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJEiAOTZwgh
Name 2- phenoxypropane-1,3-diol
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c10-6-9(7-11)12-8-4-2-1-3-5-8/h1-5,9-11H,6-7H2
InChIKey IEAGXQUAKGSSHK-UHFFFAOYSA-N
Instrument Name HP 5995C
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202102211
Molecular Weight 168.192 g/mol
Reported Formula C9H12O3
SMILES OCC(CO)Oc1ccccc1
SPLASH splash10-00mx-7900000000-ae422f3bf62925c85874
Source of Spectrum CSC-15-SM8-3a
Wiley ID 1871836