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2,4-O-Isoprpylidene-1C-phenyl-D-glycero-D-gulo-hexitol
SpectraBase Compound ID 2aS8Lu4Vp0u
InChI InChI=1S/C15H22O6/c1-15(2)20-13(10(17)8-16)12(19)14(21-15)11(18)9-6-4-3-5-7-9/h3-7,10-14,16-19H,8H2,1-2H3/t10-,11+,12+,13-,14+/m1/s1
InChIKey STCUWXNSQKFEAE-HTOAHKCRSA-N
Mol Weight 298.33 g/mol
Molecular Formula C15H22O6
Exact Mass 298.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rAoeGarmRd
Name 2,4-O-Isoprpylidene-1C-phenyl-D-glycero-D-gulo-hexitol
Alternate Name(s) 2,4-O-(1-methylethylidene)-1-C-phenylhexitol 2,4-O-Isopropylidene-1-C-phenyl-D-glycero-D-gulo-hexitol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O6
InChI InChI=1S/C15H22O6/c1-15(2)20-13(10(17)8-16)12(19)14(21-15)11(18)9-6-4-3-5-7-9/h3-7,10-14,16-19H,8H2,1-2H3/t10-,11+,12+,13-,14+/m1/s1
InChIKey STCUWXNSQKFEAE-HTOAHKCRSA-N
Molecular Weight 298.335 g/mol
SMILES O[C@@]([C@]1(OC(O[C@]([C@]1(O)[H])([C@](c1ccccc1)(O)[H])[H])(C)C)[H])(CO)[H]
SPLASH splash10-0a4i-0900000000-3e4f2e49401ea88dcf48
Source of Spectrum F-48-8663-10
Wiley ID 1300749