CID 20829144

1-[1-(2,3-dimethylbicyclo[2.2.1]hept-2-yl)ethoxy]-2-propanol

Structural Information

Molecular Formula
C14H26O2
SMILES
CC1C2CCC(C2)C1(C)C(C)OCC(C)O
InChI
InChI=1S/C14H26O2/c1-9(15)8-16-11(3)14(4)10(2)12-5-6-13(14)7-12/h9-13,15H,5-8H2,1-4H3
InChIKey
GNLKEDIFSGQWMA-UHFFFAOYSA-N
Compound name
1-[1-(2,3-dimethyl-2-bicyclo[2.2.1]heptanyl)ethoxy]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

226.19328 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.20056 155.9
[M+Na]+ 249.18250 162.4
[M+NH4]+ 244.22710 165.5
[M+K]+ 265.15644 159.4
[M-H]- 225.18600 155.0
[M+Na-2H]- 247.16795 156.1
[M]+ 226.19273 156.4
[M]- 226.19383 156.4
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

patents stripe