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Methyl (3R)-3-{benzyl[(1R)-1-phenylethyl]amino}dodecanoate
SpectraBase Compound ID 4dHwZwDy8YX
InChI InChI=1S/C28H41NO2/c1-4-5-6-7-8-9-16-21-27(22-28(30)31-3)29(23-25-17-12-10-13-18-25)24(2)26-19-14-11-15-20-26/h10-15,17-20,24,27H,4-9,16,21-23H2,1-3H3/t24-,27-/m1/s1
InChIKey NAHPVVPAKKIDRJ-SHQCIBLASA-N
Mol Weight 423.6 g/mol
Molecular Formula C28H41NO2
Exact Mass 423.31373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsFf5V6WgTv
Name Methyl (3R)-3-{benzyl[(1R)-1-phenylethyl]amino}dodecanoate
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Formula C28H41NO2
InChI InChI=1S/C28H41NO2/c1-4-5-6-7-8-9-16-21-27(22-28(30)31-3)29(23-25-17-12-10-13-18-25)24(2)26-19-14-11-15-20-26/h10-15,17-20,24,27H,4-9,16,21-23H2,1-3H3/t24-,27-/m1/s1
InChIKey NAHPVVPAKKIDRJ-SHQCIBLASA-N
Molecular Weight 423.641 g/mol
SMILES C(C[C@@](CCCCCCCCC)(N([C@](C)(c1ccccc1)[H])Cc1ccccc1)[H])(=O)OC
SPLASH splash10-052g-3962000000-8779386026b7511aa533
Source of Spectrum KD-14-1939-14
Wiley ID 1636089