SpectraBase Spectrum ID |
AVY9n4ygVPI |
Name |
1,4,5-tri-O-acetyl-2,4-di-O-methylxylitol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
322.126382279 u |
Formula |
C13H22O9 |
InChI |
InChI=1S/C13H22O9/c1-8(14)20-6-11(18-4)12(17)13(19-5,22-10(3)16)7-21-9(2)15/h11-12,17H,6-7H2,1-5H3/t11-,12+,13+/m0/s1 |
InChIKey |
QGRHNOATCITBLK-YNEHKIRRSA-N |
Instrument Name |
TRIO-2 VG |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/np010332x |
Molecular Weight |
322.310 g/mol |
Quality |
16 |
SMILES |
O[C@]([C@](COC(C)=O)(OC)[H])([C@](COC(C)=O)(OC)OC(=O)C)[H] |
SPLASH |
splash10-0006-9000000000-91e564ca9ecf49ef899a |
Source of Spectrum |
G4-65-156-156-3 (DOI: 10.1021/np010332x) |
Wiley ID |
1894540 |