CID 102267718

Dtxsid801194656

Structural Information

Molecular Formula
C11H20O
SMILES
CC1([C@@H]2CC[C@@H](C2)[C@H]1CCO)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/t8-,9+,10+/m0/s1
InChIKey
DUINBOMGEZFPDK-IVZWLZJFSA-N
Compound name
2-[(1S,2R,4R)-3,3-dimethyl-2-bicyclo[2.2.1]heptanyl]ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

168.15141 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.15869 141.6
[M+Na]+ 191.14063 149.2
[M-H]- 167.14413 143.2
[M+NH4]+ 186.18523 169.1
[M+K]+ 207.11457 146.3
[M+H-H2O]+ 151.14867 138.6
[M+HCOO]- 213.14961 160.9
[M+CH3COO]- 227.16526 178.8
[M+Na-2H]- 189.12608 144.4
[M]+ 168.15086 140.7
[M]- 168.15196 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.