CID 3016654
1-(4-methoxyphenyl)propane-1,2-diol
Structural Information
- Molecular Formula
- C10H14O3
- SMILES
- CC(C(C1=CC=C(C=C1)OC)O)O
- InChI
- InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3
- InChIKey
- MRDZSBVJWOXBRW-UHFFFAOYSA-N
- Compound name
- 1-(4-methoxyphenyl)propane-1,2-diol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 183.10158 | 139.1 |
[M+Na]+ | 205.08352 | 150.0 |
[M+NH4]+ | 200.12812 | 146.5 |
[M+K]+ | 221.05746 | 145.7 |
[M-H]- | 181.08702 | 139.5 |
[M+Na-2H]- | 203.06897 | 144.1 |
[M]+ | 182.09375 | 140.6 |
[M]- | 182.09485 | 140.6 |