CID 21149642

Ns00092545

Structural Information

Molecular Formula
C23H25N2
SMILES
CN(C)C1=CC=C(C=C1)C2=CC=CC=C2C=C3C=CC(=[N+](C)C)C=C3
InChI
InChI=1S/C23H25N2/c1-24(2)21-13-9-18(10-14-21)17-20-7-5-6-8-23(20)19-11-15-22(16-12-19)25(3)4/h5-17H,1-4H3/q+1
InChIKey
NQOFJDVSGMSYOF-UHFFFAOYSA-N
Compound name
[4-[[2-[4-(dimethylamino)phenyl]phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.20178 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.209056 185.2
[M+Na]+ 352.190998 189.8
[M-H]- 328.194504 197.0
[M+NH4]+ 347.235603 199.0
[M+K]+ 368.164938 179.4
[M+H-H2O]+ 312.199040 177.5
[M+HCOO]- 374.199981 209.2
[M+CH3COO]- 388.215631 215.2
[M+Na-2H]- 350.176446 188.8
[M]+ 329.20123142 182.7
[M]- 329.20232858 182.7
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.