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(3S)-3-(Benzoxycarbonylamino)but-1-yne

View entire compound with spectra: 1 MS (GC)

(3S)-3-(Benzoxycarbonylamino)but-1-yne
SpectraBase Compound ID pNFnqk2BLw
InChI InChI=1S/C12H13NO2/c1-3-10(2)13-12(14)15-9-11-7-5-4-6-8-11/h1,4-8,10H,9H2,2H3,(H,13,14)/t10-/m0/s1
InChIKey PKTVPNRRPSWWMS-JTQLQIEISA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FNeik502WfY
Name (3S)-3-(Benzoxycarbonylamino)but-1-yne
Alternate Name(s) benzyl (1S)-1-methyl-2-propynylcarbamate N-[(2S)-but-3-yn-2-yl]carbamic acid (phenylmethyl) ester benzyl N-[(2S)-but-3-yn-2-yl]carbamate benzyl N-[(1S)-1-methylprop-2-ynyl]carbamate (phenylmethyl) N-[(2S)-but-3-yn-2-yl]carbamate
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Formula C12H13NO2
InChI InChI=1S/C12H13NO2/c1-3-10(2)13-12(14)15-9-11-7-5-4-6-8-11/h1,4-8,10H,9H2,2H3,(H,13,14)/t10-/m0/s1
InChIKey PKTVPNRRPSWWMS-JTQLQIEISA-N
Molecular Weight 203.241 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@](C#C)(C)[H]
SPLASH splash10-052f-9600000000-c11c9d65fb76f50d4f52
Source of Spectrum K-2002-538-30
Wiley ID 1580869