CID 82837457
1543507-04-5
Structural Information
- Molecular Formula
- C7H12O4
- SMILES
- COC(=O)C(C1CCCO1)O
- InChI
- InChI=1S/C7H12O4/c1-10-7(9)6(8)5-3-2-4-11-5/h5-6,8H,2-4H2,1H3
- InChIKey
- BZQUQFNNKKQENP-UHFFFAOYSA-N
- Compound name
- methyl 2-hydroxy-2-(oxolan-2-yl)acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 161.08084 | 133.5 |
[M+Na]+ | 183.06278 | 141.3 |
[M+NH4]+ | 178.10738 | 140.3 |
[M+K]+ | 199.03672 | 140.5 |
[M-H]- | 159.06628 | 133.7 |
[M+Na-2H]- | 181.04823 | 135.2 |
[M]+ | 160.07301 | 134.2 |
[M]- | 160.07411 | 134.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.