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]+ 139.11174 130.3
[M+Na]+ 161.09368 139.6
[M-H]- 137.09718 132.7
[M+NH4]+ 156.13828 157.3
[M+K]+ 177.06762 137.2
[M+H-H2O]+ 121.10172 127.3
[M+HCOO]- 183.10266 151.7
[M+CH3COO]- 197.11831 174.0
[M+Na-2H]- 159.07913 133.4
[M]+ 138.10391 130.2
[M]- 138.10501 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.