1,4:3,6-Dianhydro-2-deoxy-5-O-(1-naphthylcarbamoyl)-2-{[4-(trifluoromethyl)benzoyl]amino}-D-glucitol

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Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-[[4-(Trifluoromethyl)benzoyl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-naphthalen-1-ylcarbamate

ID: Reference12702

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[4-(trifluoromethyl)benzoyl]amino]-, 5-(1-naphthalenylcarbamate);
NAT6-269934

Formula: C25H21F3N2O5

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-5-O-(1-naphthylcarbamoyl)-2-{[4-(trifluoromethyl)benzoyl]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 2398
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/15/2023 8:14:12 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C25H21F3N2O5/c26-25(27,28)16-10-8-15(9-11-16)23(31)29-19-12-33-22-20(13-34-21(19)22)35-24(32)30-18-7-3-5-14-4-1-2-6-17(14)18/h1-11,19-22H,12-13H2,(H,29,31)(H,30,32)/t19-,20+,21+,22+/m0/s1
InChI Key PUZOCHKIUWYYRZ-DXBBTUNJSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)OC(=O)NC3=CC=CC4=CC=CC=C43)NC(=O)C5=CC=C(C=C5)C(F)(F)F
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[[4-(trifluoromethyl)benzoyl]amino]-, 5-(1-naphthalenylcarbamate);
NAT6-269934

In Other Databases

ChemSpider 10058313
PubChem 11883985