CID 12905098
Isoxazol-5-ylmethanol
Structural Information
- Molecular Formula
- C4H5NO2
- SMILES
- C1=C(ON=C1)CO
- InChI
- InChI=1S/C4H5NO2/c6-3-4-1-2-5-7-4/h1-2,6H,3H2
- InChIKey
- QOOSRUMHBCVQFK-UHFFFAOYSA-N
- Compound name
- 1,2-oxazol-5-ylmethanol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 100.03931 | 114.8 |
[M+Na]+ | 122.02125 | 126.4 |
[M+NH4]+ | 117.06585 | 123.0 |
[M+K]+ | 137.99519 | 123.7 |
[M-H]- | 98.024754 | 116.3 |
[M+Na-2H]- | 120.00670 | 120.5 |
[M]+ | 99.031481 | 116.6 |
[M]- | 99.032579 | 116.6 |