CID 44064

62469-24-3

Structural Information

Molecular Formula
C21H26N2
SMILES
CN(C)CCNCC=C1C2=CC=CC=C2CCC3=CC=CC=C31
InChI
InChI=1S/C21H26N2/c1-23(2)16-15-22-14-13-21-19-9-5-3-7-17(19)11-12-18-8-4-6-10-20(18)21/h3-10,13,22H,11-12,14-16H2,1-2H3
InChIKey
RLIXHJNFXRBQPN-UHFFFAOYSA-N
Compound name
N',N'-dimethyl-N-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)ethyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.2096 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.21688 174.9
[M+Na]+ 329.19882 185.6
[M+NH4]+ 324.24342 183.5
[M+K]+ 345.17276 177.5
[M-H]- 305.20232 179.9
[M+Na-2H]- 327.18427 181.1
[M]+ 306.20905 177.9
[M]- 306.21015 177.9
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.