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S-Methyl 2-[4-(2-amino-ethyl)phenoxy]-3-phenyl-propanoate
SpectraBase Compound ID GTGdlLuJqty
InChI InChI=1S/C18H21NO3/c1-21-18(20)17(13-15-5-3-2-4-6-15)22-16-9-7-14(8-10-16)11-12-19/h2-10,17H,11-13,19H2,1H3/t17-/m0/s1
InChIKey HHLCCUDZTNMMBU-KRWDZBQOSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJVfHDEqv6w
Name S-Methyl 2-[4-(2-amino-ethyl)phenoxy]-3-phenyl-propanoate
Appearance Yellow oil
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Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-21-18(20)17(13-15-5-3-2-4-6-15)22-16-9-7-14(8-10-16)11-12-19/h2-10,17H,11-13,19H2,1H3/t17-/m0/s1
InChIKey HHLCCUDZTNMMBU-KRWDZBQOSA-N
Instrument Name HP 6890-5973
Ionization Type EI
Literature Reference DOI 10.1021/jm201306q
Molecular Weight 299.370 g/mol
SMILES NCCc1ccc(O[C@@](Cc2ccccc2)(C(OC)=O)[H])cc1
SPLASH splash10-00di-0790000000-42c1e35107bf6981ce97
Source of Spectrum AF-55-SM4-S-5a
Wiley ID 1852003