Systematic / IUPAC Name: 1-[(3S,3aR,6R,6aR)-6-Hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-(4-phenoxyphenyl)urea
ID: Reference12216
Other Names:
D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[[(4-phenoxyphenyl)amino]carbonyl]amino]-;
NAT6-274560
Formula: C19H20N2O5
1,4:3,6-Dianhydro-2-deoxy-2-{[(4-phenoxyphenyl)carbamoyl]amino}-D-glucitol 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 | 1250 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 2/3/2023 9:09:48 AM |
InChI | InChI=1S/C19H20N2O5/c22-16-11-25-17-15(10-24-18(16)17)21-19(23)20-12-6-8-14(9-7-12)26-13-4-2-1-3-5-13/h1-9,15-18,22H,10-11H2,(H2,20,21,23)/t15-,16+,17+,18+/m0/s1 |
InChI Key | QTCMYHAJLZNPLT-BSDSXHPESA-N |
Canonical SMILES | C1C(C2C(O1)C(CO2)O)NC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4 |
CAS | |
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Other Names |
D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[[(4-phenoxyphenyl)amino]carbonyl]amino]-; NAT6-274560 |