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Propyl 4-hydroxybenzoate
SpectraBase Compound ID EIncnuDFi4k
InChI InChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3
InChIKey QELSKZZBTMNZEB-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUDglq1zyqG
Name Propylparaben
CAS Registry Number 94-13-3
Classification Preservative
Comments Spectrum verified by crosschecking against external libraries (three 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 180.078644243 u
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3
InChIKey QELSKZZBTMNZEB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 180.203 g/mol
Nominal Mass 180 u
Quality 983
Retention Index 1300
SMILES OC=1C=CC(C(OCCC)=O)=CC1
SPLASH splash10-00dr-3900000000-f7a26fd6b78df5eec0bb
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms p-Hydroxybenzoesaeurepropyl ester propyl-4-hydroxy benzoate
Technique GC/MS
Wiley ID DD2024_003777