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3-Methoxybenzoic acid heptyl ester
SpectraBase Compound ID HPTxPTscLkL
InChI InChI=1S/C15H22O3/c1-3-4-5-6-7-11-18-15(16)13-9-8-10-14(12-13)17-2/h8-10,12H,3-7,11H2,1-2H3
InChIKey NDQYJNNGAZICSH-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KF5uA7JytfT
Name Benzoic acid, 3-methoxy-, heptyl ester
CAS Registry Number 69833-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-3-4-5-6-7-11-18-15(16)13-9-8-10-14(12-13)17-2/h8-10,12H,3-7,11H2,1-2H3
InChIKey NDQYJNNGAZICSH-UHFFFAOYSA-N
Molecular Weight 250.338 g/mol
SMILES CCCCCCCOC(c1cccc(c1)OC)=O
SPLASH splash10-0udi-0910000000-4b999ec8dfde5d1ffab0
Source of Spectrum W5-21966-0-0
Synonyms Heptyl 3-methoxybenzoate 3-Methoxybenzoic acid heptyl ester m-Methoxybenzoic acid, heptyl ester
Wiley ID 1253545