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1,4-Butane diol dibenzoate
SpectraBase Compound ID BhwQZCGRudS
InChI InChI=1S/C18H18O4/c19-17(15-9-3-1-4-10-15)21-13-7-8-14-22-18(20)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
InChIKey YHOWYTOWCBNTHB-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUHPqpSSS9B
Name 4-(Benzoyloxy)butyl benzoate
Alternate Name(s) 1,4-Butanediol, dibenzoate 1,4-Butylene glycol dibenzoate 4-(Phenylcarbonyloxy)butyl benzoate benzoic acid 4-benzoyloxybutyl ester Benzoic acid, butylene ester BRN 1993579 NSC 94554
CAS Registry Number 19224-27-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c19-17(15-9-3-1-4-10-15)21-13-7-8-14-22-18(20)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
InChIKey YHOWYTOWCBNTHB-UHFFFAOYSA-N
Molecular Weight 298.338 g/mol
SMILES C(OCCCCOC(=O)c1ccccc1)(=O)c1ccccc1
SPLASH splash10-0a4i-7900000000-12b08648a1a8f05f577e
Source of Spectrum IC-855-0-0
Wiley ID 1301059