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

*Links on SpectraBase are not permalinks.
Propylparaben AC
SpectraBase Compound ID 64hquiT3BNG
InChI InChI=1S/C12H14O4/c1-3-8-15-12(14)10-4-6-11(7-5-10)16-9(2)13/h4-7H,3,8H2,1-2H3
InChIKey OYBWQECAYFAZPW-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 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 wkOzzozGrv
Name Propylparaben AC
Classification Preservative
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 222.089208927 u
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-3-8-15-12(14)10-4-6-11(7-5-10)16-9(2)13/h4-7H,3,8H2,1-2H3
InChIKey OYBWQECAYFAZPW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 222.240 g/mol
Nominal Mass 222 u
Quality 994
Retention Index 1597
SMILES C=1(C(OCCC)=O)C=CC(=CC1)OC(=O)C
SPLASH splash10-0079-4900000000-0aeab7d3ce947f40dcf3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Acetoxy-benzoic acid propyl ester Propyl 4-(acetyloxy)benzoate
Technique GC/MS
Wiley ID DD2024_024583