CID 35992

31897-92-4

Structural Information

Molecular Formula
C14H24BrN
SMILES
CC(CC12CC3CC(C1)CC(C3)C2Br)NC
InChI
InChI=1S/C14H24BrN/c1-9(16-2)6-14-7-10-3-11(8-14)5-12(4-10)13(14)15/h9-13,16H,3-8H2,1-2H3
InChIKey
WARBFBZIVXACJQ-UHFFFAOYSA-N
Compound name
1-(2-bromo-1-adamantyl)-N-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.10922 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.11650 167.1
[M+Na]+ 308.09844 171.2
[M-H]- 284.10194 164.9
[M+NH4]+ 303.14304 192.5
[M+K]+ 324.07238 160.6
[M+H-H2O]+ 268.10648 166.7
[M+HCOO]- 330.10742 171.9
[M+CH3COO]- 344.12307 176.2
[M+Na-2H]- 306.08389 175.7
[M]+ 285.10867 183.5
[M]- 285.10977 183.5
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.