CID 53939915

{7,7-dimethylbicyclo[2.2.1]heptan-1-yl}methanol

Structural Information

Molecular Formula
C10H18O
SMILES
CC1(C2CCC1(CC2)CO)C
InChI
InChI=1S/C10H18O/c1-9(2)8-3-5-10(9,7-11)6-4-8/h8,11H,3-7H2,1-2H3
InChIKey
IXBIZIOXHQMYSZ-UHFFFAOYSA-N
Compound name
(7,7-dimethyl-1-bicyclo[2.2.1]heptanyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

154.13577 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.143046 137.0
[M+Na]+ 177.124988 145.1
[M-H]- 153.128494 138.8
[M+NH4]+ 172.169593 166.7
[M+K]+ 193.098928 142.3
[M+H-H2O]+ 137.133030 134.3
[M+HCOO]- 199.133971 156.6
[M+CH3COO]- 213.149621 174.5
[M+Na-2H]- 175.110436 142.0
[M]+ 154.13522142 135.7
[M]- 154.13631858 135.7
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

patents stripe