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3-O-Benzoyl-1,2-isopropylidene-4,5(S)-O,S-carbonyl-.beta.L-idofuranose
SpectraBase Compound ID IeGQHGTfCbg
InChI InChI=1S/C17H18O7S/c1-17(2)23-13-12(21-14(18)9-6-4-3-5-7-9)11(22-15(13)24-17)10-8-20-16(19)25-10/h3-7,10-13,15H,8H2,1-2H3
InChIKey VMSMPQZYKPBJQF-UHFFFAOYSA-N
Mol Weight 366.38 g/mol
Molecular Formula C17H18O7S
Exact Mass 366.077324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqkidTqfobX
Name 3-O-Benzoyl-1,2-isopropylidene-4,5(S)-O,S-carbonyl-.beta.L-idofuranose
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O7S
InChI InChI=1S/C17H18O7S/c1-17(2)23-13-12(21-14(18)9-6-4-3-5-7-9)11(22-15(13)24-17)10-8-20-16(19)25-10/h3-7,10-13,15H,8H2,1-2H3
InChIKey VMSMPQZYKPBJQF-UHFFFAOYSA-N
Molecular Weight 366.384 g/mol
SMILES C12C(C(C3SC(=O)OC3)OC1OC(O2)(C)C)OC(=O)c1ccccc1
SPLASH splash10-0udi-0009000000-2c60cd9ee72335eae3f0
Source of Spectrum E1-44-1473-8
Wiley ID 1553464