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3-[(Benzyloxycarbonyl)amino]propan(thio)oyl-amide
SpectraBase Compound ID 2GDJTc2ZXbJ
InChI InChI=1S/C11H14N2O2S/c12-10(16)6-7-13-11(14)15-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H2,12,16)(H,13,14)
InChIKey QHEDAKTWMKKBTE-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C11H14N2O2S
Exact Mass 238.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HaQNf9YNHrj
Name 3-[(Benzyloxycarbonyl)amino]propan(thio)oyl-amide
Comments Less than 3 mono-isotopic peaks
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Formula C11H14N2O2S
InChI InChI=1S/C11H14N2O2S/c12-10(16)6-7-13-11(14)15-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H2,12,16)(H,13,14)
InChIKey QHEDAKTWMKKBTE-UHFFFAOYSA-N
Molecular Weight 238.305 g/mol
SMILES N(C(=O)OCc1ccccc1)CCC(=S)N
SPLASH splash10-000f-9070000000-9699e2194c8a564315ad
Source of Spectrum D8-326-275-7
Synonyms N-(3-amino-3-sulfanylidenepropyl)carbamic acid (phenylmethyl) ester benzyl N-(3-amino-3-sulfanylidenepropyl)carbamate benzyl N-(3-amino-3-thioxo-propyl)carbamate (phenylmethyl) N-(3-azanyl-3-sulfanylidene-propyl)carbamate
Wiley ID 1514756