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1,3-Propanediol, 2-(octadecyloxy)-, monoacetate, (.+-.)-
SpectraBase Compound ID 4oKKdJncQRH
InChI InChI=1S/C23H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-23(20-24)21-27-22(2)25/h23-24H,3-21H2,1-2H3/t23-/m1/s1
InChIKey MIVUNINUDAGNHI-HSZRJFAPSA-N
Mol Weight 386.6 g/mol
Molecular Formula C23H46O4
Exact Mass 386.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WcKgDFaOi0
Name 1,3-Propanediol, 2-(octadecyloxy)-, monoacetate, (.+-.)-
Alternate Name(s) (2R)-3-hydroxy-2-(octadecyloxy)propyl acetate (R,S)-2-(octadecyloxy)propan-1,3-diol-1-acetate
CAS Registry Number 82521-22-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H46O4
InChI InChI=1S/C23H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-23(20-24)21-27-22(2)25/h23-24H,3-21H2,1-2H3/t23-/m1/s1
InChIKey MIVUNINUDAGNHI-HSZRJFAPSA-N
Molecular Weight 386.617 g/mol
SMILES OC[C@](COC(=O)C)(OCCCCCCCCCCCCCCCCCC)[H]
SPLASH splash10-0pb9-0809000000-26698f6ba7480b72e307
Source of Spectrum F-39-2216-0
Wiley ID 1362821