For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3-Propane diol dibenzoate
SpectraBase Compound ID Tb88rmnvmE
InChI InChI=1S/C17H16O4/c18-16(14-8-3-1-4-9-14)20-12-7-13-21-17(19)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey SSEOOCRUUJYCKA-UHFFFAOYSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6zhPTXKQLmg
Name 3-(Benzoyloxy)propyl benzoate
Alternate Name(s) 1,3-Propanediol, dibenzoate 3-(Phenylcarbonyloxy)propyl benzoate Benzoflex S-432 benzoic acid 3-benzoyloxypropyl ester Benzoic acid diester with trimethylolethane TMETB Trimethyleneglycol, dibenzoate Trimethylolethane benzoate BRN 2057480 NSC 94553
CAS Registry Number 2451-86-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O4
InChI InChI=1S/C17H16O4/c18-16(14-8-3-1-4-9-14)20-12-7-13-21-17(19)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey SSEOOCRUUJYCKA-UHFFFAOYSA-N
Molecular Weight 284.311 g/mol
SMILES C(CCOC(=O)c1ccccc1)OC(=O)c1ccccc1
SPLASH splash10-0a4i-3900000000-a46f3b9ddf5236d5bba2
Source of Spectrum W5-1989-35946-29590
Wiley ID 1288055