CID 13029207
35694-75-8
Structural Information
- Molecular Formula
- C10H12Br2
- SMILES
- C1=CC=C(C=C1)CC(CBr)CBr
- InChI
- InChI=1S/C10H12Br2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-5,10H,6-8H2
- InChIKey
- XFUUFBLWGWFPHO-UHFFFAOYSA-N
- Compound name
- [3-bromo-2-(bromomethyl)propyl]benzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 290.93785 | 144.8 |
[M+Na]+ | 312.91979 | 154.2 |
[M-H]- | 288.92329 | 151.1 |
[M+NH4]+ | 307.96439 | 164.1 |
[M+K]+ | 328.89373 | 138.9 |
[M+H-H2O]+ | 272.92783 | 153.0 |
[M+HCOO]- | 334.92877 | 160.3 |
[M+CH3COO]- | 348.94442 | 203.0 |
[M+Na-2H]- | 310.90524 | 151.7 |
[M]+ | 289.93002 | 178.4 |
[M]- | 289.93112 | 178.4 |