5-O-[(4-Acetylphenyl)carbamoyl]-1,4:3,6-dianhydro-2-deoxy-2-(2-furoylamino)-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-(Furan-2-carbonylamino)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(4-acetylphenyl)carbamate

ID: Reference11037

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[(2-furanylcarbonyl)amino]-, 5-[(4-acetylphenyl)carbamate];
NAT6-270910

Formula: C20H20N2O7

Spectral Data

5-O-[(4-Acetylphenyl)carbamoyl]-1,4:3,6-dianhydro-2-deoxy-2-(2-furoylamino)-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 1641
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/19/2021 11:35:50 AM
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Identificators

InChI InChI=1S/C20H20N2O7/c1-11(23)12-4-6-13(7-5-12)21-20(25)29-16-10-28-17-14(9-27-18(16)17)22-19(24)15-3-2-8-26-15/h2-8,14,16-18H,9-10H2,1H3,(H,21,25)(H,22,24)/t14-,16+,17+,18+/m0/s1
InChI Key CTEKGDOORFDMAW-DZOHQFGASA-N
Canonical SMILES CC(=O)C1=CC=C(C=C1)NC(=O)OC2COC3C2OCC3NC(=O)C4=CC=CO4
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[(2-furanylcarbonyl)amino]-, 5-[(4-acetylphenyl)carbamate];
NAT6-270910

In Other Databases

ChemSpider 10058477
PubChem 11884149