CID 67760064

Exo-2-methyl-3-methylenebicyclo[2.2.1]heptan-2-ol

Structural Information

Molecular Formula
C9H14O
SMILES
CC1(C2CCC(C2)C1=C)O
InChI
InChI=1S/C9H14O/c1-6-7-3-4-8(5-7)9(6,2)10/h7-8,10H,1,3-5H2,2H3
InChIKey
RZEAOYIZHBELOJ-UHFFFAOYSA-N
Compound name
2-methyl-3-methylidenebicyclo[2.2.1]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

138.10446 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.111736 131.2
[M+Na]+ 161.093678 139.9
[M-H]- 137.097184 133.2
[M+NH4]+ 156.138283 159.7
[M+K]+ 177.067618 136.9
[M+H-H2O]+ 121.101720 128.5
[M+HCOO]- 183.102661 151.3
[M+CH3COO]- 197.118311 171.9
[M+Na-2H]- 159.079126 135.0
[M]+ 138.10391142 128.8
[M]- 138.10500858 128.8
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