CID 11040931
96232-90-5
Structural Information
- Molecular Formula
- C7H12N2O2
- SMILES
- COC(=O)NCCCCC#N
- InChI
- InChI=1S/C7H12N2O2/c1-11-7(10)9-6-4-2-3-5-8/h2-4,6H2,1H3,(H,9,10)
- InChIKey
- CGWUSLSXMSPPJK-UHFFFAOYSA-N
- Compound name
- methyl N-(4-cyanobutyl)carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 157.09715 | 135.4 |
[M+Na]+ | 179.07909 | 143.8 |
[M+NH4]+ | 174.12369 | 138.9 |
[M+K]+ | 195.05303 | 136.0 |
[M-H]- | 155.08259 | 127.6 |
[M+Na-2H]- | 177.06454 | 136.2 |
[M]+ | 156.08932 | 133.2 |
[M]- | 156.09042 | 133.2 |
Literature stripe
No literature data available for this compound.