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2,6-Anhydro-1,3-O-benzylidene-7-deoxy-7-nitro-L-glycero-L-galacto-heptitol
SpectraBase Compound ID 6QPQR0LHtaR
InChI InChI=1S/C14H17NO7/c16-11-9(6-15(18)19)21-10-7-20-14(22-13(10)12(11)17)8-4-2-1-3-5-8/h1-5,9-14,16-17H,6-7H2/t9-,10+,11-,12+,13-,14-/m0/s1
InChIKey VDZYDQXBRJWDNV-IIEFLBBWSA-N
Mol Weight 311.29 g/mol
Molecular Formula C14H17NO7
Exact Mass 311.100502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2cLeijxYFE5
Name 2,6-Anhydro-1,3-O-benzylidene-7-deoxy-7-nitro-L-glycero-L-galacto-heptitol
Alternate Name(s) (2S,4aR,6S,7R,8R,8aR)-6-Nitromethyl-2-phenyl-hexahydro-pyrano[3,2-d][1,3]dioxine-7,8-diol 2,6-anhydro-5,7-O-benzylidene-1-deoxy-1-nitro-D-glycero-L-manno-heptitol 2,6-Anhydro-7-deoxy-1,3-O-benzylidene-7-nitro-L-glycero-L-galacto-heptitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO7
InChI InChI=1S/C14H17NO7/c16-11-9(6-15(18)19)21-10-7-20-14(22-13(10)12(11)17)8-4-2-1-3-5-8/h1-5,9-14,16-17H,6-7H2/t9-,10+,11-,12+,13-,14-/m0/s1
InChIKey VDZYDQXBRJWDNV-IIEFLBBWSA-N
Molecular Weight 311.290 g/mol
SMILES O[C@@]1([C@]([C@@](O[C@@]2(CO[C@@](O[C@]12[H])(c1ccccc1)[H])[H])(CN(=O)=O)[H])(O)[H])[H]
SPLASH splash10-0a4i-7911000000-b056372719bd730b0627
Source of Spectrum O-34-1324-3
Wiley ID 763433