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Methyl N-Benzylidene-(S)-valinate
SpectraBase Compound ID 3J2mok6vwAZ
InChI InChI=1S/C13H17NO2/c1-10(2)12(13(15)16-3)14-9-11-7-5-4-6-8-11/h4-10,12H,1-3H3/b14-9+/t12-/m0/s1
InChIKey SWJMYFGBQCCKMR-IGVUGNCQSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FaRylBQBW07
Name Methyl N-Benzylidene-(S)-valinate
Alternate Name(s) methyl (2S)-3-methyl-2-{[(E)-phenylmethylidene]amino}butanoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-10(2)12(13(15)16-3)14-9-11-7-5-4-6-8-11/h4-10,12H,1-3H3/b14-9+/t12-/m0/s1
InChIKey SWJMYFGBQCCKMR-IGVUGNCQSA-N
Molecular Weight 219.284 g/mol
SMILES [C@](\N=C\c1ccccc1)(C(=O)OC)(C(C)C)[H]
SPLASH splash10-03di-0900000000-14bb12eeaf87162f43ac
Source of Spectrum J-59-7773-1
Wiley ID 1218952