CID 42678

58256-43-2

Structural Information

Molecular Formula
C12H23NO
SMILES
CC1(C2CCC1(C(C2)O)CN(C)C)C
InChI
InChI=1S/C12H23NO/c1-11(2)9-5-6-12(11,8-13(3)4)10(14)7-9/h9-10,14H,5-8H2,1-4H3
InChIKey
MIRJRWUZYBHBJV-UHFFFAOYSA-N
Compound name
1-[(dimethylamino)methyl]-7,7-dimethylbicyclo[2.2.1]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.17796 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.185236 147.2
[M+Na]+ 220.167178 154.5
[M-H]- 196.170684 150.3
[M+NH4]+ 215.211783 175.7
[M+K]+ 236.141118 152.7
[M+H-H2O]+ 180.175220 144.2
[M+HCOO]- 242.176161 167.6
[M+CH3COO]- 256.191811 189.8
[M+Na-2H]- 218.152626 150.6
[M]+ 197.17741142 147.4
[M]- 197.17850858 147.4
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

No patent data available for this compound.