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Methyl 3-(N-benzylcarbamoyl)propanoate
SpectraBase Compound ID 8kTq9SDg090
InChI InChI=1S/C12H15NO3/c1-16-12(15)8-7-11(14)13-9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,14)
InChIKey PERYWTURIOYMTD-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7r4rLOLKCwE
Name Methyl 3-(N-benzylcarbamoyl)propanoate
Alternate Name(s) (phenylmethyl) N-[(2S)-1-oxidanylbut-3-en-2-yl]carbamate benzyl (1S)-1-(hydroxymethyl)-2-propenylcarbamate Benzyl (S)-[1-(Hydroxymethyl)allyl]carbamate benzyl N-[(1S)-1-(hydroxymethyl)allyl]carbamate benzyl N-[(2S)-1-hydroxybut-3-en-2-yl]carbamate N-Benzyl-succinamic acid methyl ester N-[(1S)-1-methylolallyl]carbamic acid benzyl ester N-[(2S)-1-hydroxybut-3-en-2-yl]carbamic acid (phenylmethyl) ester 4-oxo-4-[(phenylmethyl)amino]butanoic acid methyl ester methyl 4-(benzylamino)-4-oxobutanoate methyl 4-(benzylamino)-4-oxo-butanoate methyl 4-oxidanylidene-4-[(phenylmethyl)amino]butanoate
Comments Less than 3 mono-isotopic peaks
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Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-16-12(15)8-7-11(14)13-9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,14)
InChIKey PERYWTURIOYMTD-UHFFFAOYSA-N
Molecular Weight 221.256 g/mol
SMILES N(C(=O)CCC(=O)OC)Cc1ccccc1
SPLASH splash10-0006-9000000000-e7ba8c88a41a33a33969
Source of Spectrum F-51-1500-3
Wiley ID 790945