1,4:3,6-Dianhydro-2-deoxy-2-(2-furoylamino)-5-O-[(4-isopropylphenyl)carbamoyl]-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-propan-2-ylphenyl)carbamate

ID: Reference10911

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[(2-furanylcarbonyl)amino]-, 5-[[4-(1-methylethyl)phenyl]carbamate];
NAT6-270325

Formula: C21H24N2O6

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-2-(2-furoylamino)-5-O-[(4-isopropylphenyl)carbamoyl]-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 2225
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/1/2021 10:26:46 AM
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Identificators

InChI InChI=1S/C21H24N2O6/c1-12(2)13-5-7-14(8-6-13)22-21(25)29-17-11-28-18-15(10-27-19(17)18)23-20(24)16-4-3-9-26-16/h3-9,12,15,17-19H,10-11H2,1-2H3,(H,22,25)(H,23,24)/t15-,17+,18+,19+/m0/s1
InChI Key QLXPTDCQCUAJIZ-JCHJZTRSSA-N
Canonical SMILES CC(C)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-(1-methylethyl)phenyl]carbamate];
NAT6-270325

In Other Databases

ChemSpider 10058414
PubChem 11884086