CID 492929

(2s)-2-isopropyl-5,6,7-trimethyl-bicyclo[3.2.1]oct-6-en-8-amine

Structural Information

Molecular Formula
C14H25N
SMILES
CC1=C(C2(CC[C@H](C1C2N)C(C)C)C)C
InChI
InChI=1S/C14H25N/c1-8(2)11-6-7-14(5)10(4)9(3)12(11)13(14)15/h8,11-13H,6-7,15H2,1-5H3/t11-,12?,13?,14?/m0/s1
InChIKey
JFSODYGRGLPRJJ-YWLNHKIPSA-N
Compound name
(4S)-1,6,7-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

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.20598 151.2
[M+Na]+ 230.18792 158.7
[M-H]- 206.19142 153.8
[M+NH4]+ 225.23252 176.1
[M+K]+ 246.16186 155.5
[M+H-H2O]+ 190.19596 147.3
[M+HCOO]- 252.19690 169.3
[M+CH3COO]- 266.21255 195.3
[M+Na-2H]- 228.17337 152.0
[M]+ 207.19815 149.3
[M]- 207.19925 149.3
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.