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Methyl {2'-(benzylamino)carbonyl]-5'-hydroxy-1'-(3"-hydroxypropyl)pentyl}-carbamate
SpectraBase Compound ID CGoyL8H2VaZ
InChI InChI=1S/C18H28N2O5/c1-25-18(24)20-16(10-6-12-22)15(9-5-11-21)17(23)19-13-14-7-3-2-4-8-14/h2-4,7-8,15-16,21-22H,5-6,9-13H2,1H3,(H,19,23)(H,20,24)/t15-,16+/m1/s1
InChIKey GWSQGNQJYJHMQT-CVEARBPZSA-N
Mol Weight 352.43 g/mol
Molecular Formula C18H28N2O5
Exact Mass 352.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Lh8sSjjU8I
Name Methyl {2'-(benzylamino)carbonyl]-5'-hydroxy-1'-(3"-hydroxypropyl)pentyl}-carbamate
Alternate Name(s) N-[(4S,5R)-1,8-dihydroxy-5-[oxo-[(phenylmethyl)amino]methyl]octan-4-yl]carbamic acid methyl ester Methyl N-[(4S,5R)-5-(benzylcarbamoyl)-1,8-dihydroxyoctan-4-yl]carbamate Methyl N-[(1S,2R)-2-(benzylcarbamoyl)-5-hydroxy-1-(3-hydroxypropyl)pentyl]carbamate Methyl N-[(4S,5R)-1,8-bis(oxidanyl)-5-[(phenylmethyl)carbamoyl]octan-4-yl]carbamate
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Formula C18H28N2O5
InChI InChI=1S/C18H28N2O5/c1-25-18(24)20-16(10-6-12-22)15(9-5-11-21)17(23)19-13-14-7-3-2-4-8-14/h2-4,7-8,15-16,21-22H,5-6,9-13H2,1H3,(H,19,23)(H,20,24)/t15-,16+/m1/s1
InChIKey GWSQGNQJYJHMQT-CVEARBPZSA-N
Molecular Weight 352.431 g/mol
SMILES N(C([C@@]([C@](CCCO)(NC(=O)OC)[H])(CCCO)[H])=O)Cc1ccccc1
SPLASH splash10-0a4l-9710000000-ed483e93f8f82fece920
Source of Spectrum H-87-2715-5
Wiley ID 1564127