CID 492935

2,2,5,6,7-pentamethylbicyclo[3.2.1]oct-6-en-8-amine

Structural Information

Molecular Formula
C13H23N
SMILES
CC1=C(C2(CCC(C1C2N)(C)C)C)C
InChI
InChI=1S/C13H23N/c1-8-9(2)13(5)7-6-12(3,4)10(8)11(13)14/h10-11H,6-7,14H2,1-5H3
InChIKey
UHKURKPCBSVWGU-UHFFFAOYSA-N
Compound name
1,4,4,6,7-pentamethylbicyclo[3.2.1]oct-6-en-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.18304 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.19032 143.8
[M+Na]+ 216.17226 153.2
[M-H]- 192.17576 147.1
[M+NH4]+ 211.21686 171.5
[M+K]+ 232.14620 149.8
[M+H-H2O]+ 176.18030 140.8
[M+HCOO]- 238.18124 163.4
[M+CH3COO]- 252.19689 191.1
[M+Na-2H]- 214.15771 147.8
[M]+ 193.18249 142.7
[M]- 193.18359 142.7
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.