CID 492939

(6r,7s)-3-isopropyl-6,7-dimethyl-bicyclo[3.2.1]octan-8-amine

Structural Information

Molecular Formula
C13H25N
SMILES
C[C@@H]1[C@@H](C2CC(CC1C2N)C(C)C)C
InChI
InChI=1S/C13H25N/c1-7(2)10-5-11-8(3)9(4)12(6-10)13(11)14/h7-13H,5-6,14H2,1-4H3/t8-,9+,10?,11?,12?,13?
InChIKey
NFQXIERJVONNFQ-FXHWNGOPSA-N
Compound name
(6S,7R)-6,7-dimethyl-3-propan-2-ylbicyclo[3.2.1]octan-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.1987 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.20598 149.9
[M+Na]+ 218.18792 155.8
[M-H]- 194.19142 152.0
[M+NH4]+ 213.23252 173.1
[M+K]+ 234.16186 153.0
[M+H-H2O]+ 178.19596 145.5
[M+HCOO]- 240.19690 166.9
[M+CH3COO]- 254.21255 193.2
[M+Na-2H]- 216.17337 149.0
[M]+ 195.19815 146.0
[M]- 195.19925 146.0
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.