CID 3010133

N-(1-adamantylmethyl)-1-cyclopropyl-methanamine

Structural Information

Molecular Formula
C15H25N
SMILES
C1CC1CNCC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C15H25N/c1-2-11(1)9-16-10-15-6-12-3-13(7-15)5-14(4-12)8-15/h11-14,16H,1-10H2
InChIKey
HAYUIDQRDABUIJ-UHFFFAOYSA-N
Compound name
N-(1-adamantylmethyl)-1-cyclopropylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

219.1987 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.20598 150.0
[M+Na]+ 242.18792 152.7
[M-H]- 218.19142 148.5
[M+NH4]+ 237.23252 169.6
[M+K]+ 258.16186 148.2
[M+H-H2O]+ 202.19596 142.5
[M+HCOO]- 264.19690 156.8
[M+CH3COO]- 278.21255 158.0
[M+Na-2H]- 240.17337 160.1
[M]+ 219.19815 150.6
[M]- 219.19925 150.6
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.