CID 492933

(2r,4s)-4-isopropyl-2,6,7-trimethyl-bicyclo[3.2.1]oct-6-en-8-amine

Structural Information

Molecular Formula
C14H25N
SMILES
C[C@@H]1C[C@H](C2C(C1C(=C2C)C)N)C(C)C
InChI
InChI=1S/C14H25N/c1-7(2)11-6-8(3)12-9(4)10(5)13(11)14(12)15/h7-8,11-14H,6,15H2,1-5H3/t8-,11+,12?,13?,14?/m1/s1
InChIKey
PBJHVLWTAPTMFL-OXJACWJKSA-N
Compound name
(2R,4S)-2,6,7-trimethyl-4-propan-2-ylbicyclo[3.2.1]oct-6-en-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.1987 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.20598 152.3
[M+Na]+ 230.18792 159.8
[M-H]- 206.19142 155.1
[M+NH4]+ 225.23252 175.5
[M+K]+ 246.16186 156.6
[M+H-H2O]+ 190.19596 148.1
[M+HCOO]- 252.19690 170.5
[M+CH3COO]- 266.21255 197.0
[M+Na-2H]- 228.17337 151.3
[M]+ 207.19815 150.6
[M]- 207.19925 150.6
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.