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Acetic acid 3S-Benzylamino-2R-tert-butoxycarbonylamino-5-tri-n-butylsilylpent-4-ynyl ester
SpectraBase Compound ID 2F7terVuFP8
InChI InChI=1S/C31H52N2O4Si/c1-8-11-20-38(21-12-9-2,22-13-10-3)23-19-28(32-24-27-17-15-14-16-18-27)29(25-36-26(4)34)33-30(35)37-31(5,6)7/h14-18,28-29,32H,8-13,20-22,24-25H2,1-7H3,(H,33,35)/t28-,29?/m0/s1
InChIKey SXFWTOMBQDMXMX-XLTVJXRZSA-N
Mol Weight 544.9 g/mol
Molecular Formula C31H52N2O4Si
Exact Mass 544.369635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CERJAR84xHf
Name Acetic acid 3S-Benzylamino-2R-tert-butoxycarbonylamino-5-tri-n-butylsilylpent-4-ynyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C31H52N2O4Si
InChI InChI=1S/C31H52N2O4Si/c1-8-11-20-38(21-12-9-2,22-13-10-3)23-19-28(32-24-27-17-15-14-16-18-27)29(25-36-26(4)34)33-30(35)37-31(5,6)7/h14-18,28-29,32H,8-13,20-22,24-25H2,1-7H3,(H,33,35)/t28-,29?/m0/s1
InChIKey SXFWTOMBQDMXMX-XLTVJXRZSA-N
Molecular Weight 544.852 g/mol
SMILES N(C(OC(C)(C)C)=O)C([C@](C#C[Si](CCCC)(CCCC)CCCC)(NCc1ccccc1)[H])COC(=O)C
SPLASH splash10-00kf-9080000000-bcd3b18e203c2016f606
Source of Spectrum H1-51-1290-0
Synonyms (3S)-3-(benzylamino)-2-[(tert-butoxycarbonyl)amino]-5-(tributylsilyl)-4-pentynyl acetate
Wiley ID 817103