CID 101407815

Exo-5,6-dimethylbicyclo[2.2.1]hept-5-en-2-ol

Structural Information

Molecular Formula
C9H14O
SMILES
CC1=C(C2CC1CC2O)C
InChI
InChI=1S/C9H14O/c1-5-6(2)8-3-7(5)4-9(8)10/h7-10H,3-4H2,1-2H3
InChIKey
BRMSNMZILBBMIX-UHFFFAOYSA-N
Compound name
5,6-dimethylbicyclo[2.2.1]hept-5-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.10446 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.111736 130.3
[M+Na]+ 161.093678 139.6
[M-H]- 137.097184 132.7
[M+NH4]+ 156.138283 157.3
[M+K]+ 177.067618 137.2
[M+H-H2O]+ 121.101720 127.3
[M+HCOO]- 183.102661 151.7
[M+CH3COO]- 197.118311 174.0
[M+Na-2H]- 159.079126 133.4
[M]+ 138.10391142 130.2
[M]- 138.10500858 130.2
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

No patent data available for this compound.