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n-Pentyl 4-methoxybenzoate
SpectraBase Compound ID CDix5k241YP
InChI InChI=1S/C13H18O3/c1-3-4-5-10-16-13(14)11-6-8-12(15-2)9-7-11/h6-9H,3-5,10H2,1-2H3
InChIKey DNJKWCMASVISFH-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55dd9aatidL
Name n-Pentyl 4-methoxybenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.125594437 u
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-3-4-5-10-16-13(14)11-6-8-12(15-2)9-7-11/h6-9H,3-5,10H2,1-2H3
InChIKey DNJKWCMASVISFH-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201606048
Molecular Weight 222.284 g/mol
Quality 38
SMILES C(CCCC)OC(C1=CC=C(C=C1)OC)=O
SPLASH splash10-0udr-0910000000-8d98352ce12544c38494
Source of Spectrum QE-23-SM2-Table 3, Entry 8 (DOI: 10.1002/chem.201606048)
Wiley ID 1905547