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(1S)-[2-Hydroxy-1-(5-methyl-2,7,8-trioxabicyclo[3.2.1]oct-1-yl)ethyl]carbamic acid benzyl ester
SpectraBase Compound ID 5EHYA2PPn5l
InChI InChI=1S/C16H21NO6/c1-15-7-8-21-16(23-15,22-11-15)13(9-18)17-14(19)20-10-12-5-3-2-4-6-12/h2-6,13,18H,7-11H2,1H3,(H,17,19)/t13-,15?,16?/m0/s1
InChIKey HQULMYBGNOBMMY-JEYLPNPQSA-N
Mol Weight 323.35 g/mol
Molecular Formula C16H21NO6
Exact Mass 323.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ivc7eZ2jOJg
Name (1S)-[2-Hydroxy-1-(5-methyl-2,7,8-trioxabicyclo[3.2.1]oct-1-yl)ethyl]carbamic acid benzyl ester
Alternate Name(s) benzyl (1S)-2-hydroxy-1-(5-methyl-2,7,8-trioxabicyclo[3.2.1]oct-1-yl)ethylcarbamate
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Formula C16H21NO6
InChI InChI=1S/C16H21NO6/c1-15-7-8-21-16(23-15,22-11-15)13(9-18)17-14(19)20-10-12-5-3-2-4-6-12/h2-6,13,18H,7-11H2,1H3,(H,17,19)/t13-,15?,16?/m0/s1
InChIKey HQULMYBGNOBMMY-JEYLPNPQSA-N
Molecular Weight 323.345 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](CO)(C12OC(C)(CO2)CCO1)[H]
SPLASH splash10-000f-9200000000-83b2dbdafd0d3d82c4c7
Source of Spectrum F-53-16588-32
Wiley ID 804627