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Benzyl 2-Amino-2-methyl-3-(4-nitrophenyl)propanoate
SpectraBase Compound ID ECIT8UVRoi9
InChI InChI=1S/C17H18N2O4/c1-17(18,11-13-7-9-15(10-8-13)19(21)22)16(20)23-12-14-5-3-2-4-6-14/h2-10H,11-12,18H2,1H3
InChIKey YNZJNTPGVMAQKN-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C17H18N2O4
Exact Mass 314.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DDl4YKvEb9
Name Benzyl 2-Amino-2-methyl-3-(4-nitrophenyl)propanoate
Alternate Name(s) 2-amino-2-methyl-3-(4-nitrophenyl)propanoic acid (phenylmethyl) ester (phenylmethyl) 2-azanyl-2-methyl-3-(4-nitrophenyl)propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C17H18N2O4
InChI InChI=1S/C17H18N2O4/c1-17(18,11-13-7-9-15(10-8-13)19(21)22)16(20)23-12-14-5-3-2-4-6-14/h2-10H,11-12,18H2,1H3
InChIKey YNZJNTPGVMAQKN-UHFFFAOYSA-N
Molecular Weight 314.341 g/mol
SMILES NC(C(=O)OCc1ccccc1)(Cc1ccc(cc1)N(=O)=O)C
SPLASH splash10-0006-9000000000-c46957050ee17e517c8a
Source of Spectrum F-52-12134-1
Wiley ID 798826