CID 9574829

Nsc690242

Structural Information

Molecular Formula
C25H26N10
SMILES
C1CN=C(N1)N/N=C/C=C/C2=CC=C(C=C2)C3=CN4C=C(C=CC4=N3)/C=C/C=N/NC5=NCCN5
InChI
InChI=1S/C25H26N10/c1(11-30-33-24-26-13-14-27-24)3-19-5-8-21(9-6-19)22-18-35-17-20(7-10-23(35)32-22)4-2-12-31-34-25-28-15-16-29-25/h1-12,17-18H,13-16H2,(H2,26,27,33)(H2,28,29,34)/b3-1+,4-2+,30-11+,31-12+
InChIKey
PCQQUKYMZOPGJM-HUFMVIJWSA-N
Compound name
N-[(E)-[(E)-3-[4-[6-[(E,3E)-3-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)prop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enylidene]amino]-4,5-dihydro-1H-imidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

466.2342 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.24148 199.9
[M+Na]+ 489.22342 204.4
[M-H]- 465.22692 207.6
[M+NH4]+ 484.26802 204.8
[M+K]+ 505.19736 195.4
[M+H-H2O]+ 449.23146 186.5
[M+HCOO]- 511.23240 221.0
[M+CH3COO]- 525.24805 206.4
[M+Na-2H]- 487.20887 202.2
[M]+ 466.23365 196.9
[M]- 466.23475 196.9
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.