CID 3018334
Methyl 2-phenoxyisobutyrate
Structural Information
- Molecular Formula
- C11H14O3
- SMILES
- CC(C)(C(=O)OC)OC1=CC=CC=C1
- InChI
- InChI=1S/C11H14O3/c1-11(2,10(12)13-3)14-9-7-5-4-6-8-9/h4-8H,1-3H3
- InChIKey
- UAQIYYDCUSJYRL-UHFFFAOYSA-N
- Compound name
- methyl 2-methyl-2-phenoxypropanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 195.10158 | 141.6 |
[M+Na]+ | 217.08352 | 148.6 |
[M-H]- | 193.08702 | 145.3 |
[M+NH4]+ | 212.12812 | 161.1 |
[M+K]+ | 233.05746 | 148.2 |
[M+H-H2O]+ | 177.09156 | 136.0 |
[M+HCOO]- | 239.09250 | 163.9 |
[M+CH3COO]- | 253.10815 | 183.0 |
[M+Na-2H]- | 215.06897 | 148.3 |
[M]+ | 194.09375 | 144.7 |
[M]- | 194.09485 | 144.7 |
Literature stripe
No literature data available for this compound.