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4-Propylbenzoic acid anhydride
SpectraBase Compound ID 3BU9oqEQFDx
InChI InChI=1S/C20H22O3/c1-3-5-15-7-11-17(12-8-15)19(21)23-20(22)18-13-9-16(6-4-2)10-14-18/h7-14H,3-6H2,1-2H3
InChIKey ZOYKXWWRBJSUDD-UHFFFAOYSA-N
Mol Weight 310.39 g/mol
Molecular Formula C20H22O3
Exact Mass 310.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oOZg1w9Mxc
Name 4-Propylbenzoic acid anhydride
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 310.156894565 u
Formula C20H22O3
InChI InChI=1S/C20H22O3/c1-3-5-15-7-11-17(12-8-15)19(21)23-20(22)18-13-9-16(6-4-2)10-14-18/h7-14H,3-6H2,1-2H3
InChIKey ZOYKXWWRBJSUDD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 310.393 g/mol
Nominal Mass 310 u
Quality 999
Retention Index 2564
SMILES C1(C(OC(C=2C=CC(=CC2)CCC)=O)=O)=CC=C(C=C1)CCC
SPLASH splash10-0002-3910000000-408f7c34393c29dec032
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-propylbenzoyl 4-propylbenzoate
Technique GC/MS
Wiley ID DD2024_025335