CID 10581
1,3-cyclohexadiene, 1,5,5,6-tetramethyl-
Structural Information
- Molecular Formula
- C10H16
- SMILES
- CC1C(=CC=CC1(C)C)C
- InChI
- InChI=1S/C10H16/c1-8-6-5-7-10(3,4)9(8)2/h5-7,9H,1-4H3
- InChIKey
- LKNRSUKTEIJIAS-UHFFFAOYSA-N
- Compound name
- 1,5,5,6-tetramethylcyclohexa-1,3-diene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 137.13248 | 126.8 |
[M+Na]+ | 159.11442 | 135.7 |
[M-H]- | 135.11792 | 131.2 |
[M+NH4]+ | 154.15902 | 151.5 |
[M+K]+ | 175.08836 | 134.3 |
[M+H-H2O]+ | 119.12246 | 122.8 |
[M+HCOO]- | 181.12340 | 149.8 |
[M+CH3COO]- | 195.13905 | 176.7 |
[M+Na-2H]- | 157.09987 | 133.6 |
[M]+ | 136.12465 | 126.8 |
[M]- | 136.12575 | 126.8 |