CID 86113

110458-84-9

Structural Information

Molecular Formula
C13H24O
SMILES
CC1C(C2(CC1CC2CO)C(C)C)C
InChI
InChI=1S/C13H24O/c1-8(2)13-6-11(5-12(13)7-14)9(3)10(13)4/h8-12,14H,5-7H2,1-4H3
InChIKey
VFFUWAHBYYGDHT-UHFFFAOYSA-N
Compound name
(5,6-dimethyl-1-propan-2-yl-2-bicyclo[2.2.1]heptanyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.18271 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.18999 147.7
[M+Na]+ 219.17193 155.7
[M+NH4]+ 214.21653 158.2
[M+K]+ 235.14587 151.8
[M-H]- 195.17543 147.7
[M+Na-2H]- 217.15738 148.8
[M]+ 196.18216 148.7
[M]- 196.18326 148.7
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.