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Benzoic acid, 2-(pentyloxy)-, methyl ester
SpectraBase Compound ID 2qBRCc9DXiL
InChI InChI=1S/C13H18O3/c1-3-4-7-10-16-12-9-6-5-8-11(12)13(14)15-2/h5-6,8-9H,3-4,7,10H2,1-2H3
InChIKey PGMDHIWMVVZDGQ-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 3Tyz61Fq46x
Name Benzoic acid, 2-(pentyloxy)-, methyl ester
CAS Registry Number 21018-10-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-3-4-7-10-16-12-9-6-5-8-11(12)13(14)15-2/h5-6,8-9H,3-4,7,10H2,1-2H3
InChIKey PGMDHIWMVVZDGQ-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES CCCCCOc1ccccc1C(=O)OC
SPLASH splash10-001i-3900000000-fd0cb575efa158826b09
Source of Spectrum W5-18486-0-0
Synonyms Methyl 2-(pentyloxy)benzoate 2-Amoxybenzoic acid methyl ester 2-Pentoxybenzoic acid methyl ester Benzoic acid, o-(pentyloxy)-, methyl ester Methyl 2-pentoxybenzoate
Wiley ID 1222510