CID 2405935
565195-14-4
Structural Information
- Molecular Formula
- C9H12ClNO
- SMILES
- CC1=CC(=C(N1C)C)C(=O)CCl
- InChI
- InChI=1S/C9H12ClNO/c1-6-4-8(9(12)5-10)7(2)11(6)3/h4H,5H2,1-3H3
- InChIKey
- KINLEKFUTAPEHI-UHFFFAOYSA-N
- Compound name
- 2-chloro-1-(1,2,5-trimethylpyrrol-3-yl)ethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 186.06803 | 137.8 |
[M+Na]+ | 208.04997 | 150.7 |
[M+NH4]+ | 203.09457 | 146.2 |
[M+K]+ | 224.02391 | 146.1 |
[M-H]- | 184.05347 | 138.6 |
[M+Na-2H]- | 206.03542 | 142.7 |
[M]+ | 185.06020 | 140.1 |
[M]- | 185.06130 | 140.1 |
Literature stripe
No literature data available for this compound.