CID 85998

16423-26-0

Structural Information

Molecular Formula
C11H20O
SMILES
CC1(C2CCC(C2)C1CCO)C
InChI
InChI=1S/C11H20O/c1-11(2)9-4-3-8(7-9)10(11)5-6-12/h8-10,12H,3-7H2,1-2H3
InChIKey
DUINBOMGEZFPDK-UHFFFAOYSA-N
Compound name
2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

168.15141 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.158686 141.6
[M+Na]+ 191.140628 149.2
[M-H]- 167.144134 143.2
[M+NH4]+ 186.185233 169.1
[M+K]+ 207.114568 146.3
[M+H-H2O]+ 151.148670 138.6
[M+HCOO]- 213.149611 160.9
[M+CH3COO]- 227.165261 178.8
[M+Na-2H]- 189.126076 144.4
[M]+ 168.15086142 140.7
[M]- 168.15195858 140.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.