CID 638069
(3e)-3-methylpenta-1,3-diene
Structural Information
- Molecular Formula
- C6H10
- SMILES
- C/C=C(\C)/C=C
- InChI
- InChI=1S/C6H10/c1-4-6(3)5-2/h4-5H,1H2,2-3H3/b6-5+
- InChIKey
- BOGRNZQRTNVZCZ-AATRIKPKSA-N
- Compound name
- (3E)-3-methylpenta-1,3-diene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 83.085526 | 115.3 |
[M+Na]+ | 105.06747 | 123.1 |
[M-H]- | 81.070974 | 116.0 |
[M+NH4]+ | 100.11207 | 139.6 |
[M+K]+ | 121.04141 | 122.3 |
[M+H-H2O]+ | 65.075510 | 111.7 |
[M+HCOO]- | 127.07645 | 138.6 |
[M+CH3COO]- | 141.09210 | 165.6 |
[M+Na-2H]- | 103.05292 | 121.6 |
[M]+ | 82.077701 | 114.5 |
[M]- | 82.078799 | 114.5 |