CID 146155421

2416234-83-6

Structural Information

Molecular Formula
C8H14O2
SMILES
CC12CCC(C1)(CO2)CO
InChI
InChI=1S/C8H14O2/c1-7-2-3-8(4-7,5-9)6-10-7/h9H,2-6H2,1H3
InChIKey
NRSHLESQHYCANY-UHFFFAOYSA-N
Compound name
(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.09938 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 129.9
[M+Na]+ 165.088598 137.9
[M-H]- 141.092104 132.2
[M+NH4]+ 160.133203 158.4
[M+K]+ 181.062538 137.1
[M+H-H2O]+ 125.096640 127.5
[M+HCOO]- 187.097581 149.5
[M+CH3COO]- 201.113231 169.3
[M+Na-2H]- 163.074046 137.7
[M]+ 142.09883142 129.6
[M]- 142.09992858 129.6
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.