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2-(octadecyloxy)-1,3-propanediol
SpectraBase Compound ID 2YQPt0Bh6EH
InChI InChI=1S/C21H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-21(19-22)20-23/h21-23H,2-20H2,1H3
InChIKey YGDQPIRPQXPCJT-UHFFFAOYSA-N
Mol Weight 344.6 g/mol
Molecular Formula C21H44O3
Exact Mass 344.329045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDdNaeTf5ld
Name 1,3-Propanediol, 2-(octadecyloxy)-
Alternate Name(s) 2-octadecoxypropane-1,3-diol 2-stearyloxypropane-1,3-diol Glycerine 2-monostearyl ether
CAS Registry Number 87515-28-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H44O3
InChI InChI=1S/C21H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-21(19-22)20-23/h21-23H,2-20H2,1H3
InChIKey YGDQPIRPQXPCJT-UHFFFAOYSA-N
Molecular Weight 344.580 g/mol
SMILES OCC(CO)OCCCCCCCCCCCCCCCCCC
SPLASH splash10-0a4i-9000000000-6aa17957d1c41d846fec
Source of Spectrum F-39-2216-0
Wiley ID 1338168