CID 16913

2-methylisoborneol

Structural Information

Molecular Formula
C11H20O
SMILES
CC1(C2CCC1(C(C2)(C)O)C)C
InChI
InChI=1S/C11H20O/c1-9(2)8-5-6-10(9,3)11(4,12)7-8/h8,12H,5-7H2,1-4H3
InChIKey
LFYXNXGVLGKVCJ-UHFFFAOYSA-N
Compound name
1,2,7,7-tetramethylbicyclo[2.2.1]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

295
References

1603
Patents

168.15141 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.15869 137.5
[M+Na]+ 191.14063 146.0
[M+NH4]+ 186.18523 151.2
[M+K]+ 207.11457 138.4
[M-H]- 167.14413 137.7
[M+Na-2H]- 189.12608 142.9
[M]+ 168.15086 139.1
[M]- 168.15196 139.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe