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(2R,3S)-3-tert-Butylcarbonylamino-2-p-nitrophenylcarbonyloxy-1-butanol
SpectraBase Compound ID 1bvNAHgEOvX
InChI InChI=1S/C16H22N2O7/c1-10(17-15(21)25-16(2,3)4)13(9-19)24-14(20)11-5-7-12(8-6-11)18(22)23/h5-8,10,13,19H,9H2,1-4H3,(H,17,21)/t10-,13-/m0/s1
InChIKey IJXKQHSLNZCERS-GWCFXTLKSA-N
Mol Weight 354.36 g/mol
Molecular Formula C16H22N2O7
Exact Mass 354.142701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6m17AgNnY3
Name (2R,3S)-3-tert-Butylcarbonylamino-2-p-nitrophenylcarbonyloxy-1-butanol
Alternate Name(s) (1R,2S)-2-[(tert-butoxycarbonyl)amino]-1-(hydroxymethyl)propyl 4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O7
InChI InChI=1S/C16H22N2O7/c1-10(17-15(21)25-16(2,3)4)13(9-19)24-14(20)11-5-7-12(8-6-11)18(22)23/h5-8,10,13,19H,9H2,1-4H3,(H,17,21)/t10-,13-/m0/s1
InChIKey IJXKQHSLNZCERS-GWCFXTLKSA-N
Molecular Weight 354.359 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@]([C@](CO)(OC(c1ccc(N(=O)=O)cc1)=O)[H])(C)[H]
SPLASH splash10-0udl-0900000000-31f9c265374e24785059
Source of Spectrum QC-7-255-12
Wiley ID 869099