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Pentanoic acid, 5-phenoxy-, ethyl ester

View entire compound with spectra: 1 MS (GC)

Pentanoic acid, 5-phenoxy-, ethyl ester
SpectraBase Compound ID 4HSdjiVLxqR
InChI InChI=1S/C13H18O3/c1-2-15-13(14)10-6-7-11-16-12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3
InChIKey DNCNZDFEQZJZEN-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 3m9QSKDbn53
Name Pentanoic acid, 5-phenoxy-, ethyl ester
CAS Registry Number 69687-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-2-15-13(14)10-6-7-11-16-12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3
InChIKey DNCNZDFEQZJZEN-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES CCOC(CCCCOc1ccccc1)=O
SPLASH splash10-004l-9400000000-f8611741a4d439c1f101
Source of Spectrum W5-18493-0-0
Synonyms Ethyl 5-phenoxypentanoate 5-Phenoxypentanoic acid ethyl ester 5-Phenoxyvaleric acid ethyl ester
Wiley ID 1222520