1,4:3,6-Dianhydro-2-(benzoylamino)-2,5-dideoxy-5-{5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl}-L-iditol

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Systematic / IUPAC Name: N-[(3S,3aR,6S,6aR)-6-[5-[4-(1,2,4-Triazol-1-yl)phenoxy]tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]benzamide

ID: Reference12443

Other Names: L-Iditol, 1,4:3,6-dianhydro-2-(benzoylamino)-2,5-dideoxy-5-[5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298514

Formula: C22H20N8O4

Spectral Data

1,4:3,6-Dianhydro-2-(benzoylamino)-2,5-dideoxy-5-{5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl}-L-iditol 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 2150
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/6/2023 2:48:21 PM
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Identificators

InChI InChI=1S/C22H20N8O4/c31-21(14-4-2-1-3-5-14)25-17-10-32-20-18(11-33-19(17)20)30-22(26-27-28-30)34-16-8-6-15(7-9-16)29-13-23-12-24-29/h1-9,12-13,17-20H,10-11H2,(H,25,31)/t17-,18-,19+,20+/m0/s1
InChI Key GVEOCRFZEOOZIF-VNTMZGSJSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)N3C(=NN=N3)OC4=CC=C(C=C4)N5C=NC=N5)NC(=O)C6=CC=CC=C6
CAS
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Other Names L-Iditol, 1,4:3,6-dianhydro-2-(benzoylamino)-2,5-dideoxy-5-[5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298514

In Other Databases

PubChem 11886249
ChemSpider 10060572