CID 560044
5735-97-7
Structural Information
- Molecular Formula
- C6H10O4
- SMILES
- CC1(OCCO1)CC(=O)O
- InChI
- InChI=1S/C6H10O4/c1-6(4-5(7)8)9-2-3-10-6/h2-4H2,1H3,(H,7,8)
- InChIKey
- FTKBXLIEUSEMPP-UHFFFAOYSA-N
- Compound name
- 2-(2-methyl-1,3-dioxolan-2-yl)acetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 147.06518 | 127.0 |
[M+Na]+ | 169.04712 | 133.9 |
[M-H]- | 145.05062 | 130.4 |
[M+NH4]+ | 164.09172 | 148.4 |
[M+K]+ | 185.02106 | 136.2 |
[M+H-H2O]+ | 129.05516 | 123.5 |
[M+HCOO]- | 191.05610 | 147.0 |
[M+CH3COO]- | 205.07175 | 168.3 |
[M+Na-2H]- | 167.03257 | 134.2 |
[M]+ | 146.05735 | 127.7 |
[M]- | 146.05845 | 127.7 |