CID 165653454

{4-methoxybicyclo[2.2.1]heptan-1-yl}methanol

Structural Information

Molecular Formula
C9H16O2
SMILES
COC12CCC(C1)(CC2)CO
InChI
InChI=1S/C9H16O2/c1-11-9-4-2-8(6-9,7-10)3-5-9/h10H,2-7H2,1H3
InChIKey
LCKGAUHAYMDABW-UHFFFAOYSA-N
Compound name
(4-methoxy-1-bicyclo[2.2.1]heptanyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.11504 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.122316 136.6
[M+Na]+ 179.104258 144.2
[M-H]- 155.107764 138.2
[M+NH4]+ 174.148863 165.8
[M+K]+ 195.078198 142.2
[M+H-H2O]+ 139.112300 133.7
[M+HCOO]- 201.113241 156.8
[M+CH3COO]- 215.128891 172.4
[M+Na-2H]- 177.089706 142.9
[M]+ 156.11449142 136.1
[M]- 156.11558858 136.1
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.