CID 199343

4053-11-6

Structural Information

Molecular Formula
C19H21N
SMILES
CN(C)CC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
InChI
InChI=1S/C19H21N/c1-20(2)12-13-11-18-14-7-3-5-9-16(14)19(13)17-10-6-4-8-15(17)18/h3-10,13,18-19H,11-12H2,1-2H3
InChIKey
KOIRVMFZPVMONM-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

263.1674 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.17468 156.9
[M+Na]+ 286.15662 171.9
[M+NH4]+ 281.20122 169.8
[M+K]+ 302.13056 161.6
[M-H]- 262.16012 161.7
[M+Na-2H]- 284.14207 161.2
[M]+ 263.16685 160.8
[M]- 263.16795 160.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.