(1S,4R,6S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-6-yl hexopyranoside

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Systematic / IUPAC Name: 2-(Hydroxymethyl)-6-[[(1R,4S)-2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-yl]oxy]oxane-3,4,5-triol

ID: Reference8150

Other Names: Hexopyranoside, (1S,4R,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]oct-6-yl

Formula: C16H28O7

Spectral Data

(1S,4R,6S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-6-yl hexopyranoside 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 FAIMS
No. of Spectral Trees 1
No. of Spectra 130
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 8/20/2018 6:30:51 AM
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Identificators

InChI InChI=1S/C16H28O7/c1-15(2)8-4-5-16(3,23-15)10(6-8)22-14-13(20)12(19)11(18)9(7-17)21-14/h8-14,17-20H,4-7H2,1-3H3/t8-,9?,10?,11?,12?,13?,14?,16+/m1/s1
InChI Key NWZYTZHMCGWGOF-HLIZFUEWSA-N
Canonical SMILES CC1(C2CCC(O1)(C(C2)OC3C(C(C(C(O3)CO)O)O)O)C)C
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Other Names Hexopyranoside, (1S,4R,6S)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]oct-6-yl

In Other Databases

ChemSpider 22912966
PubChem 23844043