Systematic / IUPAC Name: N-[(3S,3aR,6S,6aR)-6-[5-[3-(Dimethylamino)phenoxy]tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-4-methoxybenzamide
ID: Reference12492
Other Names:
L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl]-5-[(4-methoxybenzoyl)amino]-;
NAT6-298272
Formula: C23H26N6O5
1,4:3,6-Dianhydro-2,5-dideoxy-2-{5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl}-5-[(4-methoxybenzoyl)amino]-L-iditol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1944 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/27/2023 2:21:48 PM |
InChI | InChI=1S/C23H26N6O5/c1-28(2)15-5-4-6-17(11-15)34-23-25-26-27-29(23)19-13-33-20-18(12-32-21(19)20)24-22(30)14-7-9-16(31-3)10-8-14/h4-11,18-21H,12-13H2,1-3H3,(H,24,30)/t18-,19-,20+,21+/m0/s1 |
InChI Key | WAPGLTPXGHGXPS-UWHLTILDSA-N |
Canonical SMILES | CN(C)C1=CC(=CC=C1)OC2=NN=NN2C3COC4C3OCC4NC(=O)C5=CC=C(C=C5)OC |
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Other Names |
L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl]-5-[(4-methoxybenzoyl)amino]-; NAT6-298272 |