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]+ 157.12232 136.6
[M+Na]+ 179.10426 144.2
[M-H]- 155.10776 138.2
[M+NH4]+ 174.14886 165.8
[M+K]+ 195.07820 142.2
[M+H-H2O]+ 139.11230 133.7
[M+HCOO]- 201.11324 156.8
[M+CH3COO]- 215.12889 172.4
[M+Na-2H]- 177.08971 142.9
[M]+ 156.11449 136.1
[M]- 156.11559 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.