CID 36026

31967-92-7

Structural Information

Molecular Formula
C15H27N
SMILES
CC(CCC12CC3CC(C1)CC(C3)C2)NC
InChI
InChI=1S/C15H27N/c1-11(16-2)3-4-15-8-12-5-13(9-15)7-14(6-12)10-15/h11-14,16H,3-10H2,1-2H3
InChIKey
MNZHGDDKHUBCII-UHFFFAOYSA-N
Compound name
4-(1-adamantyl)-N-methylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.21436 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.221636 157.3
[M+Na]+ 244.203578 157.3
[M-H]- 220.207084 151.9
[M+NH4]+ 239.248183 182.1
[M+K]+ 260.177518 153.9
[M+H-H2O]+ 204.211620 150.9
[M+HCOO]- 266.212561 163.5
[M+CH3COO]- 280.228211 164.8
[M+Na-2H]- 242.189026 166.0
[M]+ 221.21381142 156.1
[M]- 221.21490858 156.1
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.