CID 98187

2-norbornanol, 3-(benzylmethylaminomethyl)-

Structural Information

Molecular Formula
C16H23NO
SMILES
CN(CC1C2CCC(C2)C1O)CC3=CC=CC=C3
InChI
InChI=1S/C16H23NO/c1-17(10-12-5-3-2-4-6-12)11-15-13-7-8-14(9-13)16(15)18/h2-6,13-16,18H,7-11H2,1H3
InChIKey
PHMYEAYOKNYDGR-UHFFFAOYSA-N
Compound name
3-[[benzyl(methyl)amino]methyl]bicyclo[2.2.1]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

245.17796 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.18524 159.8
[M+Na]+ 268.16718 164.6
[M-H]- 244.17068 165.4
[M+NH4]+ 263.21178 182.0
[M+K]+ 284.14112 161.3
[M+H-H2O]+ 228.17522 153.8
[M+HCOO]- 290.17616 180.5
[M+CH3COO]- 304.19181 197.9
[M+Na-2H]- 266.15263 160.5
[M]+ 245.17741 158.5
[M]- 245.17851 158.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.