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5-Acetamido-4-NO-acetyl-2,7,8,9-tetra-O-acetyl-3,4,5-tridesoxy-4(E)-oximino-.alpha.,.beta.-D-manno-2-nonulopyranomethyl ester
SpectraBase Compound ID LJBRvSqj0VT
InChI InChI=1S/C22H30N2O14/c1-10(25)23-18-16(24-38-15(6)30)8-22(21(31)32-7,36-14(5)29)37-20(18)19(35-13(4)28)17(34-12(3)27)9-33-11(2)26/h17-20H,8-9H2,1-7H3,(H,23,25)/b24-16+/t17?,18-,19-,20-,22+/m1/s1
InChIKey ZJBZKJNOAJTWPL-VLNTXDSNSA-N
Mol Weight 546.48 g/mol
Molecular Formula C22H30N2O14
Exact Mass 546.169704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 255F6RGRxJU
Name 5-Acetamido-4-NO-acetyl-2,7,8,9-tetra-O-acetyl-3,4,5-tridesoxy-4(E)-oximino-.alpha.,.beta.-D-manno-2-nonulopyranomethyl ester
Alternate Name(s) 5-Acetamido-4-NO-acetyl-2,7,8,9-tetra-O-acetyl-3,4,5-tridesoxy-4(E)-oximino-alpha,.beta.-D-manno-2-nonulopyranomethyl ester 5-Acetamido-4-NO-acetyl-2,7,8,9-tetra-O-acetyl-3,4,5-tridesoxy-4(E/Z)-oximino-.alpha.,.beta.-D-manno-2-nonulopyranomethyl ester 5-Acetamido-4-NO-acetyl-2,7,8,9-tetra-O-acetyl-3,4,5-tridesoxy-4(E/Z)-oximino-alpha,.beta.-D-manno-2-nonulopyranomethyl ester methyl (4E)-2-(acetyloxy)-4-[(acetyloxy)imino]-5-acetamido-6-[(1S)-1,2,3-tris(acetyloxy)propyl]oxane-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C22H30N2O14
InChI InChI=1S/C22H30N2O14/c1-10(25)23-18-16(24-38-15(6)30)8-22(21(31)32-7,36-14(5)29)37-20(18)19(35-13(4)28)17(34-12(3)27)9-33-11(2)26/h17-20H,8-9H2,1-7H3,(H,23,25)/b24-16+/t17?,18-,19-,20-,22+/m1/s1
InChIKey ZJBZKJNOAJTWPL-VLNTXDSNSA-N
Molecular Weight 546.482 g/mol
SMILES N([C@@]1(\C(C[C@@](O[C@]1([C@@](C(OC(=O)C)COC(=O)C)(OC(=O)C)[H])[H])(OC(=O)C)C(=O)OC)=N\OC(=O)C)[H])C(=O)C
SPLASH splash10-000j-0000970000-dc8f36aec50abfb6c7de
Source of Spectrum F-54-4550-7
Wiley ID 806511