CID 5100144

Tricyclo[3.3.1.1~3,7~]decan-1-amine, 3-(1-methylethyl)-, conjugate acid

Structural Information

Molecular Formula
C13H23N
SMILES
CC(C)C12CC3CC(C1)CC(C3)(C2)N
InChI
InChI=1S/C13H23N/c1-9(2)12-4-10-3-11(5-12)7-13(14,6-10)8-12/h9-11H,3-8,14H2,1-2H3
InChIKey
UNZLVAUDWGXALA-UHFFFAOYSA-N
Compound name
3-propan-2-yladamantan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

158
Patents

193.18304 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.19032 151.2
[M+Na]+ 216.17226 153.4
[M-H]- 192.17576 146.1
[M+NH4]+ 211.21686 178.9
[M+K]+ 232.14620 149.9
[M+H-H2O]+ 176.18030 145.0
[M+HCOO]- 238.18124 157.4
[M+CH3COO]- 252.19689 159.6
[M+Na-2H]- 214.15771 160.6
[M]+ 193.18249 148.8
[M]- 193.18359 148.8
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.