CID 13455853
1,5-anhydro-4-deoxyhexitol
Structural Information
- Molecular Formula
- C6H12O4
- SMILES
- C1C(OCC(C1O)O)CO
- InChI
- InChI=1S/C6H12O4/c7-2-4-1-5(8)6(9)3-10-4/h4-9H,1-3H2
- InChIKey
- POHLHDSBJAEFFB-UHFFFAOYSA-N
- Compound name
- 6-(hydroxymethyl)oxane-3,4-diol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 149.08084 | 128.6 |
[M+Na]+ | 171.06278 | 137.9 |
[M+NH4]+ | 166.10738 | 135.6 |
[M+K]+ | 187.03672 | 134.9 |
[M-H]- | 147.06628 | 129.3 |
[M+Na-2H]- | 169.04823 | 130.8 |
[M]+ | 148.07301 | 129.7 |
[M]- | 148.07411 | 129.7 |
Literature stripe
No literature data available for this compound.