SpectraBase Spectrum ID |
2ohMarroL6a |
Name |
Lactose 8TFA |
Classification |
Sugar |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
1109.974604124 u |
Formula |
C28H14F24O19 |
InChI |
InChI=1S/C28H14F24O19/c29-21(30,31)13(53)61-1-3-5(7(67-16(56)24(38,39)40)10(70-19(59)27(47,48)49)12(64-3)71-20(60)28(50,51)52)65-11-9(69-18(58)26(44,45)46)8(68-17(57)25(41,42)43)6(66-15(55)23(35,36)37)4(63-11)2-62-14(54)22(32,33)34/h3-12H,1-2H2 |
InChIKey |
MFWYGUKAOQCCKF-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
1110.363 g/mol |
SMILES |
C1(C(C(OC(C(F)(F)F)=O)C(COC(C(F)(F)F)=O)OC1OC1C(C(C(OC(C(F)(F)F)=O)OC1COC(C(F)(F)F)=O)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O |
SPLASH |
splash10-014i-9712000000-cf196384c545fe5b1ca6 |
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_5785 |