CID 2769500
1-(3-isocyanopropyl)-2-pyrrolidinone
Structural Information
- Molecular Formula
- C8H12N2O
- SMILES
- [C-]#[N+]CCCN1CCCC1=O
- InChI
- InChI=1S/C8H12N2O/c1-9-5-3-7-10-6-2-4-8(10)11/h2-7H2
- InChIKey
- WJSKUGILKGOSGT-UHFFFAOYSA-N
- Compound name
- 1-(3-isocyanopropyl)pyrrolidin-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 153.10224 | 134.0 |
[M+Na]+ | 175.08418 | 144.9 |
[M+NH4]+ | 170.12878 | 138.9 |
[M+K]+ | 191.05812 | 138.9 |
[M-H]- | 151.08768 | 128.2 |
[M+Na-2H]- | 173.06963 | 135.5 |
[M]+ | 152.09441 | 132.8 |
[M]- | 152.09551 | 132.8 |
Literature stripe
No literature data available for this compound.