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]+ 246.185236 159.8
[M+Na]+ 268.167178 164.6
[M-H]- 244.170684 165.4
[M+NH4]+ 263.211783 182.0
[M+K]+ 284.141118 161.3
[M+H-H2O]+ 228.175220 153.8
[M+HCOO]- 290.176161 180.5
[M+CH3COO]- 304.191811 197.9
[M+Na-2H]- 266.152626 160.5
[M]+ 245.17741142 158.5
[M]- 245.17850858 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.