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OXAZOLIDINONE-XESTOAMINOL-A

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OXAZOLIDINONE-XESTOAMINOL-A
SpectraBase Compound ID 5EwMmgt6roy
InChI InChI=1S/C15H27NO2/c1-3-4-5-6-7-8-9-10-11-12-14-13(2)16-15(17)18-14/h4-5,13-14H,3,6-12H2,1-2H3,(H,16,17)/b5-4+/t13-,14+/m0/s1
InChIKey MZXUHQJXBCWWKO-OOPLNXAUSA-N
Mol Weight 253.39 g/mol
Molecular Formula C15H27NO2
Exact Mass 253.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HNOdqI86K60
Name (4S,5R)-4-Methyl-5-(8'-undecen-1'-yl)-oxazolidin-2-one
Comments Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 1603623 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H27NO2
InChI InChI=1S/C15H27NO2/c1-3-4-5-6-7-8-9-10-11-12-14-13(2)16-15(17)18-14/h4-5,13-14H,3,6-12H2,1-2H3,(H,16,17)/b5-4+/t13-,14+/m0/s1
InChIKey MZXUHQJXBCWWKO-OOPLNXAUSA-N
Molecular Weight 253.386 g/mol
SMILES N1[C@]([C@](OC1=O)(CCCCCCC\C=C\CC)[H])(C)[H]
SPLASH splash10-0zfu-0290000000-3a1dbe9eee1bf83b4c7e
Source of Spectrum X2-53-982-5
Synonyms (4S,5R)-4-methyl-5-[(8E)-8-undecenyl]-1,3-oxazolidin-2-one 4-Methyl-5-(8'-undecen-1'-yl)-oxazolidin-2-one Oxazolidinone-xestoaminol A
Wiley ID 1821067