CID 59188306
147045-24-7
Structural Information
- Molecular Formula
- C12H20NO2
- SMILES
- CC1(CC(CC(N1[O])(C)C)OCC#C)C
- InChI
- InChI=1S/C12H20NO2/c1-6-7-15-10-8-11(2,3)13(14)12(4,5)9-10/h1,10H,7-9H2,2-5H3
- InChIKey
- POEBHISKBXRUBH-UHFFFAOYSA-N
- Compound name
- None
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 211.15668 | 140.3 |
[M+Na]+ | 233.13862 | 151.0 |
[M-H]- | 209.14212 | 141.9 |
[M+NH4]+ | 228.18322 | 160.3 |
[M+K]+ | 249.11256 | 147.8 |
[M+H-H2O]+ | 193.14666 | 130.1 |
[M+HCOO]- | 255.14760 | 154.0 |
[M+CH3COO]- | 269.16325 | 196.5 |
[M+Na-2H]- | 231.12407 | 144.6 |
[M]+ | 210.14885 | 136.6 |
[M]- | 210.14995 | 136.6 |