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(3R,4R,RS)-N-(tert-Butylsulfinyl)-4-nitro-1-phenylpentan-3-amine
SpectraBase Compound ID 5JumXWT91XK
InChI InChI=1S/C15H24N2O3S/c1-12(17(18)19)14(16-21(20)15(2,3)4)11-10-13-8-6-5-7-9-13/h5-9,12,14,16H,10-11H2,1-4H3/t12-,14-,21?/m1/s1
InChIKey QLOXZXPXZWEYEC-STKUKEJNSA-N
Mol Weight 312.43 g/mol
Molecular Formula C15H24N2O3S
Exact Mass 312.150764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GssRq4DvtK
Name (3R,4R,RS)-N-(tert-Butylsulfinyl)-4-nitro-1-phenylpentan-3-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24N2O3S
InChI InChI=1S/C15H24N2O3S/c1-12(17(18)19)14(16-21(20)15(2,3)4)11-10-13-8-6-5-7-9-13/h5-9,12,14,16H,10-11H2,1-4H3/t12-,14-,21?/m1/s1
InChIKey QLOXZXPXZWEYEC-STKUKEJNSA-N
Molecular Weight 312.428 g/mol
SMILES N([S@@](C(C)(C)C)=O)[C@@]([C@](N(=O)=O)(C)[H])(CCc1ccccc1)[H]
SPLASH splash10-0f6x-7900000000-70e2279daeee5f569ebe
Source of Spectrum QC-25-370-7c
Synonyms (3R,4R/,RS)-N-(tert-Butylsulfinyl)-4-nitro-1-phenylpentan-3-amine (R)-2-methyl-N-((3R,4R)-4-nitro-1-phenylpentan-3-yl)propane-2-sulfinamide
Wiley ID 1742718