CID 578237
514-95-4
Structural Information
- Molecular Formula
- C10H16
- SMILES
- CC1=CCCC(C1=C)(C)C
- InChI
- InChI=1S/C10H16/c1-8-6-5-7-10(3,4)9(8)2/h6H,2,5,7H2,1,3-4H3
- InChIKey
- FMXKKHBXBBAQBC-UHFFFAOYSA-N
- Compound name
- 1,5,5-trimethyl-6-methylidenecyclohexene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 137.13248 | 127.3 |
[M+Na]+ | 159.11442 | 135.4 |
[M-H]- | 135.11792 | 131.4 |
[M+NH4]+ | 154.15902 | 151.8 |
[M+K]+ | 175.08836 | 133.6 |
[M+H-H2O]+ | 119.12246 | 123.4 |
[M+HCOO]- | 181.12340 | 149.0 |
[M+CH3COO]- | 195.13905 | 176.1 |
[M+Na-2H]- | 157.09987 | 133.1 |
[M]+ | 136.12465 | 125.1 |
[M]- | 136.12575 | 125.1 |