CID 86243127
2-isocyanato-1,1-dimethoxypropane
Structural Information
- Molecular Formula
- C6H11NO3
- SMILES
- CC(C(OC)OC)N=C=O
- InChI
- InChI=1S/C6H11NO3/c1-5(7-4-8)6(9-2)10-3/h5-6H,1-3H3
- InChIKey
- XSKPXLHSPIQLLU-UHFFFAOYSA-N
- Compound name
- 2-isocyanato-1,1-dimethoxypropane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 146.08118 | 128.9 |
[M+Na]+ | 168.06312 | 135.8 |
[M-H]- | 144.06662 | 130.7 |
[M+NH4]+ | 163.10772 | 150.7 |
[M+K]+ | 184.03706 | 137.6 |
[M+H-H2O]+ | 128.07116 | 123.6 |
[M+HCOO]- | 190.07210 | 154.4 |
[M+CH3COO]- | 204.08775 | 179.8 |
[M+Na-2H]- | 166.04857 | 134.3 |
[M]+ | 145.07335 | 132.9 |
[M]- | 145.07445 | 132.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.