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Isobutyl 2-(3-(pyridin-2-yl)phenyl)propanoate
SpectraBase Compound ID 2xy5WRx3xH4
InChI InChI=1S/C18H21NO2/c1-13(2)12-21-18(20)14(3)15-7-6-8-16(11-15)17-9-4-5-10-19-17/h4-11,13-14H,12H2,1-3H3
InChIKey OGVKOQXGQBTFSG-UHFFFAOYSA-N
Mol Weight 283.37 g/mol
Molecular Formula C18H21NO2
Exact Mass 283.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bnm5SQ2wzEW
Name Isobutyl 2-(3-(pyridin-2-yl)phenyl)propanoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c1-13(2)12-21-18(20)14(3)15-7-6-8-16(11-15)17-9-4-5-10-19-17/h4-11,13-14H,12H2,1-3H3
InChIKey OGVKOQXGQBTFSG-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/chem.202003622
Reported Formula C18H21NO2
SMILES C(OC(=O)C(c1cccc(-c2ccccn2)c1)C)C(C)C
SPLASH splash10-001i-0920000000-750af3ecb183d488cc8c
Source of Spectrum QE-26-SM64-3ac
Wiley ID 1841184