3,5-bis(Acetyloxy)-2-(1,3-benzothiazol-2-yl)tetrahydro-2H-pyran-4-yl acetate

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Systematic / IUPAC Name: 2,3,4-tri-O-Acetyl-1,5-anhydro-1-(1,3-benzothiazol-2-yl)pentitol

ID: Reference3976

Other Names: Pentitol, 1,5-anhydro-1-C-2-benzothiazolyl-, 2,3,4-triacetate

Formula: C18H19NO7S

Spectral Data

3,5-bis(Acetyloxy)-2-(1,3-benzothiazol-2-yl)tetrahydro-2H-pyran-4-yl acetate 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 Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/26/2016 12:05:08 PM
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Identificators

InChI InChI=1S/C18H19NO7S/c1-9(20)24-13-8-23-17(16(26-11(3)22)15(13)25-10(2)21)18-19-12-6-4-5-7-14(12)27-18/h4-7,13,15-17H,8H2,1-3H3
InChI Key UKYUZPFZYHYAOI-UHFFFAOYSA-N
Canonical SMILES CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)C2=NC3=CC=CC=C3S2
CAS
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Other Names Pentitol, 1,5-anhydro-1-C-2-benzothiazolyl-, 2,3,4-triacetate

In Other Databases

PubChem 3737015
ChemSpider 2967158