CID 107330

Hydronopol

Structural Information

Molecular Formula
C11H20O
SMILES
CC1(C2CCC(C1C2)CCO)C
InChI
InChI=1S/C11H20O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h8-10,12H,3-7H2,1-2H3
InChIKey
RCRVMCSPZAMFKV-UHFFFAOYSA-N
Compound name
2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

127
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 150.2
[M+Na]+ 191.14063 155.2
[M-H]- 167.14413 148.2
[M+NH4]+ 186.18523 170.1
[M+K]+ 207.11457 155.5
[M+H-H2O]+ 151.14867 142.5
[M+HCOO]- 213.14961 161.8
[M+CH3COO]- 227.16526 187.2
[M+Na-2H]- 189.12608 158.4
[M]+ 168.15086 160.6
[M]- 168.15196 160.6
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.