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1,2-Propanediol, 3-[[2-(acetyloxy)hexadecyl]oxy]-, diacetate
SpectraBase Compound ID 3mINcUsmTJ7
InChI InChI=1S/C25H46O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-24(31-22(3)27)18-29-19-25(32-23(4)28)20-30-21(2)26/h24-25H,5-20H2,1-4H3
InChIKey XHNVJCVWNQNTPR-UHFFFAOYSA-N
Mol Weight 458.6 g/mol
Molecular Formula C25H46O7
Exact Mass 458.324354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51Is2W0SFZd
Name 1,2-Propanediol, 3-[[2-(acetyloxy)hexadecyl]oxy]-, diacetate
Alternate Name(s) 2-(Acetyloxy)-1-(([2-(acetyloxy)hexadecyl]oxy)methyl)ethyl acetate Acetic acid [2-acetyloxy-3-(2-acetyloxyhexadecoxy)propyl] ester [2-acetyloxy-3-(2-acetyloxyhexadecoxy)propyl] acetate [2-acetoxy-3-(2-acetoxyhexadecoxy)propyl] acetate [2-acetyloxy-3-(2-acetyloxyhexadecoxy)propyl] ethanoate
CAS Registry Number 56599-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H46O7
InChI InChI=1S/C25H46O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-24(31-22(3)27)18-29-19-25(32-23(4)28)20-30-21(2)26/h24-25H,5-20H2,1-4H3
InChIKey XHNVJCVWNQNTPR-UHFFFAOYSA-N
Molecular Weight 458.636 g/mol
SMILES C(C(CCCCCCCCCCCCCC)OC(C)=O)OCC(COC(C)=O)OC(C)=O
SPLASH splash10-0a4l-9710000000-115e57e83994c81cfa8f
Source of Spectrum EP-5256-0-0
Wiley ID 1389881