1,4:3,6-Dianhydro-2-deoxy-5-O-(1-naphthylcarbamoyl)-2-[5-(phenylsulfanyl)-1H-tetrazol-1-yl]-D-glucitol

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

ID: Reference9580

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[5-(phenylthio)-1H-tetrazol-1-yl]-, 5-(1-naphthalenylcarbamate);
NAT6-296007

Formula: C24H21N5O4S

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-5-O-(1-naphthylcarbamoyl)-2-[5-(phenylsulfanyl)-1H-tetrazol-1-yl]-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 2
No. of Spectra 2300
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 4/15/2020 7:30:38 AM
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Identificators

InChI InChI=1S/C24H21N5O4S/c30-24(25-18-12-6-8-15-7-4-5-11-17(15)18)33-20-14-32-21-19(13-31-22(20)21)29-23(26-27-28-29)34-16-9-2-1-3-10-16/h1-12,19-22H,13-14H2,(H,25,30)/t19-,20+,21+,22+/m0/s1
InChI Key NSQHUYLUENAYFK-DXBBTUNJSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)OC(=O)NC3=CC=CC4=CC=CC=C43)N5C(=NN=N5)SC6=CC=CC=C6
CAS
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Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[5-(phenylthio)-1H-tetrazol-1-yl]-, 5-(1-naphthalenylcarbamate);
NAT6-296007

In Other Databases

ChemSpider 10060323
PubChem 11886000