CID 54594613
2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-one
Structural Information
- Molecular Formula
- C10H18O2
- SMILES
- CC(C)COC1CC(=O)C1(C)C
- InChI
- InChI=1S/C10H18O2/c1-7(2)6-12-9-5-8(11)10(9,3)4/h7,9H,5-6H2,1-4H3
- InChIKey
- XWHNGZJGGCPHFF-UHFFFAOYSA-N
- Compound name
- 2,2-dimethyl-3-(2-methylpropoxy)cyclobutan-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 171.13796 | 137.5 |
[M+Na]+ | 193.11990 | 144.0 |
[M-H]- | 169.12340 | 141.5 |
[M+NH4]+ | 188.16450 | 153.9 |
[M+K]+ | 209.09384 | 146.6 |
[M+H-H2O]+ | 153.12794 | 129.2 |
[M+HCOO]- | 215.12888 | 157.9 |
[M+CH3COO]- | 229.14453 | 186.3 |
[M+Na-2H]- | 191.10535 | 140.9 |
[M]+ | 170.13013 | 148.5 |
[M]- | 170.13123 | 148.5 |
Literature stripe
No literature data available for this compound.