SpectraBase Spectrum ID |
9JI3EqJWK |
Name |
Arabinose 4PFP |
Classification |
Sugar |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
733.969245024 u |
Formula |
C17H6F20O9 |
InChI |
InChI=1S/C17H6F20O9/c18-10(19,14(26,27)28)6(38)43-2-1-42-5(46-9(41)13(24,25)17(35,36)37)4(45-8(40)12(22,23)16(32,33)34)3(2)44-7(39)11(20,21)15(29,30)31/h2-5H,1H2/t2-,3+,4+,5?/m1/s1 |
InChIKey |
LPNUZMXYYBIGOE-AGQMPKSLSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
734.194 g/mol |
SMILES |
C(C(O[C@@]1([C@@](C(OC(C(C(F)(F)F)(F)F)=O)OC[C@]1(OC(C(C(F)(F)F)(F)F)=O)[H])(OC(C(C(F)(F)F)(F)F)=O)[H])[H])=O)(C(F)(F)F)(F)F |
SPLASH |
splash10-014i-9751000000-b1b246614a3e13be8b86 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_5798 |