CID 299894

Nsc173751

Structural Information

Molecular Formula
C15H26N2
SMILES
CN(C)CC1C2C=CC(C1CN(C)C)C3C2C3
InChI
InChI=1S/C15H26N2/c1-16(2)8-14-10-5-6-11(13-7-12(10)13)15(14)9-17(3)4/h5-6,10-15H,7-9H2,1-4H3
InChIKey
KGVJBOPFTCAGIV-UHFFFAOYSA-N
Compound name
1-[7-[(dimethylamino)methyl]-6-tricyclo[3.2.2.02,4]non-8-enyl]-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.2096 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.21688 158.0
[M+Na]+ 257.19882 163.3
[M-H]- 233.20232 160.3
[M+NH4]+ 252.24342 176.4
[M+K]+ 273.17276 160.5
[M+H-H2O]+ 217.20686 151.2
[M+HCOO]- 279.20780 172.3
[M+CH3COO]- 293.22345 215.4
[M+Na-2H]- 255.18427 164.9
[M]+ 234.20905 164.5
[M]- 234.21015 164.5
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.