CID 43436574
2-(3,5-dimethoxyphenyl)-2-hydroxyacetonitrile
Structural Information
- Molecular Formula
- C10H11NO3
- SMILES
- COC1=CC(=CC(=C1)C(C#N)O)OC
- InChI
- InChI=1S/C10H11NO3/c1-13-8-3-7(10(12)6-11)4-9(5-8)14-2/h3-5,10,12H,1-2H3
- InChIKey
- ZWGBEAKJEFVQPW-UHFFFAOYSA-N
- Compound name
- 2-(3,5-dimethoxyphenyl)-2-hydroxyacetonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 194.08118 | 140.2 |
[M+Na]+ | 216.06312 | 150.2 |
[M-H]- | 192.06662 | 142.7 |
[M+NH4]+ | 211.10772 | 157.5 |
[M+K]+ | 232.03706 | 148.3 |
[M+H-H2O]+ | 176.07116 | 128.3 |
[M+HCOO]- | 238.07210 | 159.3 |
[M+CH3COO]- | 252.08775 | 194.3 |
[M+Na-2H]- | 214.04857 | 144.6 |
[M]+ | 193.07335 | 137.7 |
[M]- | 193.07445 | 137.7 |
Literature stripe
No literature data available for this compound.