CID 198737

84215-49-6

Structural Information

Molecular Formula
C23H25N3
SMILES
CN(C)C1=CC=C(C=C1)C(=C2C=CC(=N)C=C2)C3=CC=C(C=C3)N(C)C
InChI
InChI=1S/C23H25N3/c1-25(2)21-13-7-18(8-14-21)23(17-5-11-20(24)12-6-17)19-9-15-22(16-10-19)26(3)4/h5-16,24H,1-4H3
InChIKey
XYSSGYHHAUSTHC-UHFFFAOYSA-N
Compound name
4-[[4-(dimethylamino)phenyl]-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

343.20483 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.212106 185.7
[M+Na]+ 366.194048 189.4
[M-H]- 342.197554 197.4
[M+NH4]+ 361.238653 198.7
[M+K]+ 382.167988 185.2
[M+H-H2O]+ 326.202090 175.3
[M+HCOO]- 388.203031 210.2
[M+CH3COO]- 402.218681 228.8
[M+Na-2H]- 364.179496 186.8
[M]+ 343.20428142 183.3
[M]- 343.20537858 183.3
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