CID 86625

Tricyclo(3.3.1.13,7)dec-1-ylmethylamine

Structural Information

Molecular Formula
C11H19N
SMILES
C1C2CC3CC1CC(C2)(C3)CN
InChI
InChI=1S/C11H19N/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-7,12H2
InChIKey
XSOHXMFFSKTSIT-UHFFFAOYSA-N
Compound name
1-adamantylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1917
Patents

165.15175 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.15903 138.8
[M+Na]+ 188.14097 141.1
[M-H]- 164.14447 133.9
[M+NH4]+ 183.18557 165.8
[M+K]+ 204.11491 137.8
[M+H-H2O]+ 148.14901 133.1
[M+HCOO]- 210.14995 147.0
[M+CH3COO]- 224.16560 148.1
[M+Na-2H]- 186.12642 150.0
[M]+ 165.15120 136.2
[M]- 165.15230 136.2
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

patents stripe