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4-Methoxy-benzoic acid cyclopentyl ester
SpectraBase Compound ID JNAhVOkDtH3
InChI InChI=1S/C13H16O3/c1-15-11-8-6-10(7-9-11)13(14)16-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3
InChIKey XVHVFWLEKAAUSQ-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEYVUq3op8a
Name 4-Methoxy-benzoic acid cyclopentyl ester
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 220.109944372 u
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-15-11-8-6-10(7-9-11)13(14)16-12-4-2-3-5-12/h6-9,12H,2-5H2,1H3
InChIKey XVHVFWLEKAAUSQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 220.268 g/mol
Nominal Mass 220 u
Quality 995
Retention Index 1795
SMILES C=1(C(OC2CCCC2)=O)C=CC(=CC1)OC
SPLASH splash10-000i-2900000000-31a023ec4b0939a80fba
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Cyclopentyl-4-methoxy benzoate cyclopentyl 4-methoxybenzoate
Technique GC/MS
Wiley ID DD2024_015133