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(3S)-2-diazo-3-methylpentanoic acid benzyl ester
SpectraBase Compound ID 7LQDwhs9ufu
InChI InChI=1S/C13H16N2O2/c1-3-10(2)12(15-14)13(16)17-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3/t10-/m0/s1
InChIKey YCIYXXYQMMEULU-JTQLQIEISA-N
Mol Weight 232.28 g/mol
Molecular Formula C13H16N2O2
Exact Mass 232.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Spdwazy9Vp
Name (3S)-2-diazo-3-methylpentanoic acid benzyl ester
Appearance Yellow oil
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Exact Mass 232.121177761 u
Formula C13H16N2O2
InChI InChI=1S/C13H16N2O2/c1-3-10(2)12(15-14)13(16)17-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3/t10-/m0/s1
InChIKey YCIYXXYQMMEULU-JTQLQIEISA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602730
Molecular Weight 232.283 g/mol
Quality 79
Reported Formula C13H16N2O2
SMILES C(=[N+]=[N-])(C(=O)OCC1=CC=CC=C1)[C@](CC)(C)[H]
SPLASH splash10-0006-9100000000-c2afbb277569874868dd
Source of Spectrum QE-22-SM9-1h (DOI: 10.1002/chem.201602730)
Wiley ID 1904985