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2-{[(N-(t-butoxycarbonyl)-L-valyl]oxymethyl}-N-benzyl-5-nitroindoline
SpectraBase Compound ID 2VJVWEKn4Ih
InChI InChI=1S/C26H33N3O6/c1-17(2)23(27-25(31)35-26(3,4)5)24(30)34-16-21-14-19-13-20(29(32)33)11-12-22(19)28(21)15-18-9-7-6-8-10-18/h6-13,17,21,23H,14-16H2,1-5H3,(H,27,31)
InChIKey SHTRYZNNHJIVCT-UHFFFAOYSA-N
Mol Weight 483.6 g/mol
Molecular Formula C26H33N3O6
Exact Mass 483.236936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3X5ASCUYqIP
Name 2-{[(N-(t-butoxycarbonyl)-L-valyl]oxymethyl}-N-benzyl-5-nitroindoline
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Formula C26H33N3O6
InChI InChI=1S/C26H33N3O6/c1-17(2)23(27-25(31)35-26(3,4)5)24(30)34-16-21-14-19-13-20(29(32)33)11-12-22(19)28(21)15-18-9-7-6-8-10-18/h6-13,17,21,23H,14-16H2,1-5H3,(H,27,31)
InChIKey SHTRYZNNHJIVCT-UHFFFAOYSA-N
Molecular Weight 483.565 g/mol
SMILES N(C(OC(C)(C)C)=O)C(C(OCC1N(c2c(cc(N(=O)=O)cc2)C1)Cc1ccccc1)=O)C(C)C
SPLASH splash10-0006-9000000000-23dabbd02ba6c4c03b2c
Source of Spectrum Y-39-899-1
Synonyms 3-Methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid [5-nitro-1-(phenylmethyl)-2,3-dihydroindol-2-yl]methyl ester (1-benzyl-5-nitro-2,3-dihydroindol-2-yl)methyl 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate (1-benzyl-5-nitro-indolin-2-yl)methyl 2-(tert-butoxycarbonylamino)-3-methyl-butanoate [5-nitro-1-(phenylmethyl)-2,3-dihydroindol-2-yl]methyl 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
Wiley ID 1528572