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

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Systematic / IUPAC Name: 1-[(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]-3-phenylurea

ID: Reference12423

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[(phenylamino)carbonyl]amino]-5-[5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298535

Formula: C22H21N9O4

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-[(phenylcarbamoyl)amino]-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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2343
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/31/2023 3:30:18 PM
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Identificators

InChI InChI=1S/C22H21N9O4/c32-21(25-14-4-2-1-3-5-14)26-17-10-33-20-18(11-34-19(17)20)31-22(27-28-29-31)35-16-8-6-15(7-9-16)30-13-23-12-24-30/h1-9,12-13,17-20H,10-11H2,(H2,25,26,32)/t17-,18-,19+,20+/m0/s1
InChI Key DNVSETOACRHEJL-VNTMZGSJSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)N3C(=NN=N3)OC4=CC=C(C=C4)N5C=NC=N5)NC(=O)NC6=CC=CC=C6
CAS
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Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[(phenylamino)carbonyl]amino]-5-[5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298535

In Other Databases

ChemSpider 10060584
PubChem 11886261