CID 198405

Id-9206 hcl

Structural Information

Molecular Formula
C19H21N
SMILES
CNCCCC12CC(C3=CC=CC=C31)C4=CC=CC=C24
InChI
InChI=1S/C19H21N/c1-20-12-6-11-19-13-16(14-7-2-4-9-17(14)19)15-8-3-5-10-18(15)19/h2-5,7-10,16,20H,6,11-13H2,1H3
InChIKey
GNHHEQNIAAPGJW-UHFFFAOYSA-N
Compound name
N-methyl-3-(1-tetracyclo[6.6.1.02,7.09,14]pentadeca-2,4,6,9,11,13-hexaenyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

263.1674 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.17468 163.0
[M+Na]+ 286.15662 175.4
[M+NH4]+ 281.20122 175.9
[M+K]+ 302.13056 167.2
[M-H]- 262.16012 167.0
[M+Na-2H]- 284.14207 168.3
[M]+ 263.16685 166.2
[M]- 263.16795 166.2
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

patents stripe