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1,2-Propanediol, 3-[[2-(acetyloxy)heptadecyl]oxy]-, diacetate
SpectraBase Compound ID IuX9ecxkehX
InChI InChI=1S/C26H48O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(32-23(3)28)19-30-20-26(33-24(4)29)21-31-22(2)27/h25-26H,5-21H2,1-4H3
InChIKey CTCBVDVIPWSMAT-UHFFFAOYSA-N
Mol Weight 472.7 g/mol
Molecular Formula C26H48O7
Exact Mass 472.340004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAtnPdziCMb
Name 1,2-Propanediol, 3-[[2-(acetyloxy)heptadecyl]oxy]-, diacetate
CAS Registry Number 57346-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H48O7
InChI InChI=1S/C26H48O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(32-23(3)28)19-30-20-26(33-24(4)29)21-31-22(2)27/h25-26H,5-21H2,1-4H3
InChIKey CTCBVDVIPWSMAT-UHFFFAOYSA-N
Molecular Weight 472.663 g/mol
SMILES C(C(CCCCCCCCCCCCCCC)OC(C)=O)OCC(COC(C)=O)OC(C)=O
SPLASH splash10-0a4i-8920100000-436a578296c1008d7c45
Source of Spectrum EP-8586-0-0
Synonyms 2-(Acetyloxy)-1-(([2-(acetyloxy)heptadecyl]oxy)methyl)ethyl acetate Acetic acid [2-acetyloxy-3-(2-acetyloxyheptadecoxy)propyl] ester [2-acetyloxy-3-(2-acetyloxyheptadecoxy)propyl] acetate [2-acetoxy-3-(2-acetoxyheptadecoxy)propyl] acetate [2-acetyloxy-3-(2-acetyloxyheptadecoxy)propyl] ethanoate
Wiley ID 1393383