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3-(Acetyloxy)-1-[(acetyloxy)methyl]-2-(benzoyloxy)propyl benzoate
SpectraBase Compound ID 3KLt1NEXgXg
InChI InChI=1S/C22H22O8/c1-15(23)27-13-19(29-21(25)17-9-5-3-6-10-17)20(14-28-16(2)24)30-22(26)18-11-7-4-8-12-18/h3-12,19-20H,13-14H2,1-2H3
InChIKey PAUMWSJQGRCQFY-UHFFFAOYSA-N
Mol Weight 414.41 g/mol
Molecular Formula C22H22O8
Exact Mass 414.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cxf07JSkjfr
Name 3-(Acetyloxy)-1-[(acetyloxy)methyl]-2-(benzoyloxy)propyl benzoate
CAS Registry Number 74793-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O8
InChI InChI=1S/C22H22O8/c1-15(23)27-13-19(29-21(25)17-9-5-3-6-10-17)20(14-28-16(2)24)30-22(26)18-11-7-4-8-12-18/h3-12,19-20H,13-14H2,1-2H3
InChIKey PAUMWSJQGRCQFY-UHFFFAOYSA-N
Molecular Weight 414.410 g/mol
SMILES C(OC(C)=O)C(C(OC(c1ccccc1)=O)COC(C)=O)OC(c1ccccc1)=O
SPLASH splash10-0a4i-2910000000-27b478644696286f5408
Source of Spectrum HE-1982-0-0
Synonyms (1,4-diacetyloxy-3-benzoyloxybutan-2-yl) benzoate 1,2,3,4-Butanetetrol, 1,4-diacetate 2,3-dibenzoate, [S-(R*,R*)]- benzoic acid (1,4-diacetyloxy-3-benzoyloxybutan-2-yl) ester [3-acetoxy-1-(acetoxymethyl)-2-benzoyloxy-propyl] benzoate [1,4-diacetyloxy-3-(phenylcarbonyloxy)butan-2-yl] benzoate
Wiley ID 1375324