CID 20161657
4-(1,1,2,2-tetramethylpropyl)phenol
Structural Information
- Molecular Formula
- C13H20O
- SMILES
- CC(C)(C)C(C)(C)C1=CC=C(C=C1)O
- InChI
- InChI=1S/C13H20O/c1-12(2,3)13(4,5)10-6-8-11(14)9-7-10/h6-9,14H,1-5H3
- InChIKey
- HPXKISLLCCBHDQ-UHFFFAOYSA-N
- Compound name
- 4-(2,3,3-trimethylbutan-2-yl)phenol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 193.15869 | 144.7 |
[M+Na]+ | 215.14063 | 152.0 |
[M-H]- | 191.14413 | 147.3 |
[M+NH4]+ | 210.18523 | 164.3 |
[M+K]+ | 231.11457 | 149.7 |
[M+H-H2O]+ | 175.14867 | 140.3 |
[M+HCOO]- | 237.14961 | 163.6 |
[M+CH3COO]- | 251.16526 | 184.1 |
[M+Na-2H]- | 213.12608 | 151.2 |
[M]+ | 192.15086 | 145.0 |
[M]- | 192.15196 | 145.0 |
Literature stripe
No literature data available for this compound.