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anti-1,1-Dimethylethyl 3-[(Benzylamino)methyl]-3-hydroxybutanoate
SpectraBase Compound ID 3rmm949xrWr
InChI InChI=1S/C16H25NO3/c1-15(2,3)20-14(18)10-16(4,19)12-17-11-13-8-6-5-7-9-13/h5-9,17,19H,10-12H2,1-4H3
InChIKey YVOLNVQUDSRBEO-UHFFFAOYSA-N
Mol Weight 279.38 g/mol
Molecular Formula C16H25NO3
Exact Mass 279.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuWoE8lrD53
Name anti-1,1-Dimethylethyl 3-[(Benzylamino)methyl]-3-hydroxybutanoate
Alternate Name(s) syn-1,1-Dimethylethyl 3-[(Benzylamino)methyl]-3-hydroxybutanoate tert-butyl 4-(benzylamino)-3-hydroxy-3-methylbutanoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H25NO3
InChI InChI=1S/C16H25NO3/c1-15(2,3)20-14(18)10-16(4,19)12-17-11-13-8-6-5-7-9-13/h5-9,17,19H,10-12H2,1-4H3
InChIKey YVOLNVQUDSRBEO-UHFFFAOYSA-N
Molecular Weight 279.380 g/mol
SMILES OC(CNCc1ccccc1)(CC(OC(C)(C)C)=O)C
SPLASH splash10-0006-9000000000-2f586186352495b69f2b
Source of Spectrum J-60-6519-5
Wiley ID 1283076