CID 16072332

3,7-dimethyloct-6-enal (2,8-dimethylquinolin-4-yl)hydrazone

Structural Information

Molecular Formula
C21H29N3
SMILES
CC1=C2C(=CC=C1)C(=CC(=N2)C)NN=CCC(C)CCC=C(C)C
InChI
InChI=1S/C21H29N3/c1-15(2)8-6-9-16(3)12-13-22-24-20-14-18(5)23-21-17(4)10-7-11-19(20)21/h7-8,10-11,13-14,16H,6,9,12H2,1-5H3,(H,23,24)
InChIKey
SIYMPMLKSRAXIA-UHFFFAOYSA-N
Compound name
N-(3,7-dimethyloct-6-enylideneamino)-2,8-dimethylquinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

323.23615 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.24343 184.0
[M+Na]+ 346.22537 189.3
[M-H]- 322.22887 187.7
[M+NH4]+ 341.26997 198.5
[M+K]+ 362.19931 184.2
[M+H-H2O]+ 306.23341 175.1
[M+HCOO]- 368.23435 205.0
[M+CH3COO]- 382.25000 222.0
[M+Na-2H]- 344.21082 185.7
[M]+ 323.23560 186.2
[M]- 323.23670 186.2
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.