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QVHJKRQXHIMCTL-UHFFFAOYSA-N
SpectraBase Compound ID L9TJVKrE8Pd
InChI InChI=1S/C10H10O4/c1-7(11)14-9-5-3-4-8(6-9)10(12)13-2/h3-6H,1-2H3
InChIKey QVHJKRQXHIMCTL-UHFFFAOYSA-N
Mol Weight 194.19 g/mol
Molecular Formula C10H10O4
Exact Mass 194.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IECvqjms0O
Name 3-(Acetyloxy)benzoic acid methyl ester
CAS Registry Number 24781-23-5
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 194.057908798 u
Formula C10H10O4
InChI InChI=1S/C10H10O4/c1-7(11)14-9-5-3-4-8(6-9)10(12)13-2/h3-6H,1-2H3
InChIKey QVHJKRQXHIMCTL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 194.186 g/mol
Nominal Mass 194 u
Quality 994
Retention Index 1396
SMILES C=1(C=C(OC(=O)C)C=CC1)C(OC)=O
SPLASH splash10-0fkc-4900000000-582a4c679b9035e9a799
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl 3-(acetyloxy)benzoate
Technique GC/MS
Wiley ID DD2024_005613