1,4:3,6-Dianhydro-2-deoxy-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-tetrazol-1-yl]-D-glucitol

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Systematic / IUPAC Name: (3S,3aR,6R,6aR)-3-[5-(2,3-Dihydro-1,4-benzodioxin-6-yl)tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-ol

ID: Reference12278

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-tetrazol-1-yl]-;
NAT6-296361

Formula: C15H16N4O5

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-tetrazol-1-yl]-D-glucitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1115
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/20/2023 12:05:28 PM
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Identificators

InChI InChI=1S/C15H16N4O5/c20-10-7-24-13-9(6-23-14(10)13)19-15(16-17-18-19)8-1-2-11-12(5-8)22-4-3-21-11/h1-2,5,9-10,13-14,20H,3-4,6-7H2/t9-,10+,13+,14+/m0/s1
InChI Key UIZAUJGJSHZGCB-GZZJDILISA-N
Canonical SMILES C1COC2=C(O1)C=CC(=C2)C3=NN=NN3C4COC5C4OCC5O
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-tetrazol-1-yl]-;
NAT6-296361

In Other Databases

PubChem 11886052
ChemSpider 10060375