CID 19332

N-isopropyl-1-adamantanamine hydrochloride

Structural Information

Molecular Formula
C13H23N
SMILES
CC(C)NC12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C13H23N/c1-9(2)14-13-6-10-3-11(7-13)5-12(4-10)8-13/h9-12,14H,3-8H2,1-2H3
InChIKey
FSMRLILYPRGBDS-UHFFFAOYSA-N
Compound name
N-propan-2-yladamantan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

57
Patents

193.18304 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.19032 148.1
[M+Na]+ 216.17226 149.0
[M-H]- 192.17576 143.2
[M+NH4]+ 211.21686 174.1
[M+K]+ 232.14620 146.1
[M+H-H2O]+ 176.18030 142.1
[M+HCOO]- 238.18124 155.1
[M+CH3COO]- 252.19689 156.5
[M+Na-2H]- 214.15771 157.9
[M]+ 193.18249 146.3
[M]- 193.18359 146.3
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