1,4:3,6-Dianhydro-5-O-benzyl-2-{benzyl[4-(2-methyl-2-propanyl)-2-pyrimidinyl]amino}-2-deoxy-D-glucitol

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Systematic / IUPAC Name: N-[(3S,3aR,6R,6aS)-6-Phenylmethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-N-benzyl-4-tert-butylpyrimidin-2-amine

ID: Reference11860

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[4-(1,1-dimethylethyl)-2-pyrimidinyl](phenylmethyl)amino]-5-O-(phenylmethyl)-;
NAT6-346376

Formula: C28H33N3O3

Spectral Data

1,4:3,6-Dianhydro-5-O-benzyl-2-{benzyl[4-(2-methyl-2-propanyl)-2-pyrimidinyl]amino}-2-deoxy-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 1135
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/17/2022 8:38:48 AM
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Identificators

InChI InChI=1S/C28H33N3O3/c1-28(2,3)24-14-15-29-27(30-24)31(16-20-10-6-4-7-11-20)22-18-33-26-23(19-34-25(22)26)32-17-21-12-8-5-9-13-21/h4-15,22-23,25-26H,16-19H2,1-3H3/t22-,23+,25+,26+/m0/s1
InChI Key NXAWNCNINYWKPN-BKJQLSFMSA-N
Canonical SMILES CC(C)(C)C1=NC(=NC=C1)N(CC2=CC=CC=C2)C3COC4C3OCC4OCC5=CC=CC=C5
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[4-(1,1-dimethylethyl)-2-pyrimidinyl](phenylmethyl)amino]-5-O-(phenylmethyl)-;
NAT6-346376

In Other Databases

ChemSpider 10115530
PubChem 11941211