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.beta.-D-threo-Pent-4-enopyranose, 4-deoxy-1,2-O-(1-methylethylidene)-, 4-nitrobenzoate
SpectraBase Compound ID Eu8xk1SaIvf
InChI InChI=1S/C15H15NO7/c1-15(2)22-12-11(7-8-20-14(12)23-15)21-13(17)9-3-5-10(6-4-9)16(18)19/h3-8,11-12,14H,1-2H3/t11-,12+,14-/m1/s1
InChIKey VQWQFBAEJNRTCT-MBNYWOFBSA-N
Mol Weight 321.29 g/mol
Molecular Formula C15H15NO7
Exact Mass 321.084852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KW8rqB3BAmr
Name .beta.-D-threo-Pent-4-enopyranose, 4-deoxy-1,2-O-(1-methylethylidene)-, 4-nitrobenzoate
Alternate Name(s) 4-deoxy-1,2-O-(1-methylethylidene)-3-O-(4-nitrobenzoyl)-.alpha.-D-threo-pent-4-enopyranose 4-Deoxy-1,2-O-isopropyliden-3-(4-nitrobenzoyl)-.beta.-D-threo-pent-4-enopyranose 5H-1,3-dioxolo[4,5-b]pyran, .beta.-D-threo-pent-4-enopyranose deriv.
CAS Registry Number 60885-03-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO7
InChI InChI=1S/C15H15NO7/c1-15(2)22-12-11(7-8-20-14(12)23-15)21-13(17)9-3-5-10(6-4-9)16(18)19/h3-8,11-12,14H,1-2H3/t11-,12+,14-/m1/s1
InChIKey VQWQFBAEJNRTCT-MBNYWOFBSA-N
Molecular Weight 321.285 g/mol
SMILES [C@]12([C@@](OC(O2)(C)C)(OC=C[C@]1(OC(c1ccc(N(=O)=O)cc1)=O)[H])[H])[H]
SPLASH splash10-0udi-8910000000-83b5ca531790dc92d650
Source of Spectrum K-109-2859-0
Wiley ID 1320802