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4-Hydroxy-benzoic acid methyl ester
SpectraBase Compound ID HXMFAFHR06b
InChI InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3
InChIKey LXCFILQKKLGQFO-UHFFFAOYSA-N
Mol Weight 152.15 g/mol
Molecular Formula C8H8O3
Exact Mass 152.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFVpaAG2FIu
Name Methylparaben
CAS Registry Number 99-76-3
Classification Preservative
Comments Spectrum verified by crosschecking against external libraries (seven 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 152.047344115 u
Formula C8H8O3
InChI InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3
InChIKey LXCFILQKKLGQFO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 152.149 g/mol
Nominal Mass 152 u
Quality 990
Retention Index 1462
SMILES OC1=CC=C(C(OC)=O)C=C1
SPLASH splash10-00di-7900000000-0361613a408efd75784e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzoic acid,4-hydroxy-,methyl ester Methyl 4-hydroxybenzoate
Technique GC/MS
Wiley ID DD2024_032064