1,4:3,6-Dianhydro-5-O-benzyl-2-deoxy-2-[(4-phenyl-2-pyrimidinyl)amino]-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]-4-phenylpyrimidin-2-amine

ID: Reference13117

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-5-O-(phenylmethyl)-2-[(4-phenyl-2-pyrimidinyl)amino]-;
NAT6-318826

Formula: C23H23N3O3

Spectral Data

1,4:3,6-Dianhydro-5-O-benzyl-2-deoxy-2-[(4-phenyl-2-pyrimidinyl)amino]-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 670
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/26/2024 9:56:09 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C23H23N3O3/c1-3-7-16(8-4-1)13-27-20-15-29-21-19(14-28-22(20)21)26-23-24-12-11-18(25-23)17-9-5-2-6-10-17/h1-12,19-22H,13-15H2,(H,24,25,26)/t19-,20+,21+,22+/m0/s1
InChI Key UBCRRJTYHOCLLC-DXBBTUNJSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)OCC3=CC=CC=C3)NC4=NC=CC(=N4)C5=CC=CC=C5
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-5-O-(phenylmethyl)-2-[(4-phenyl-2-pyrimidinyl)amino]-;
NAT6-318826

In Other Databases

ChemSpider 10086320
PubChem 11911997