CID 16600

Victoria blue r

Structural Information

Molecular Formula
C29H31N3
SMILES
CCN=C1C=CC(=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=CC=C14
InChI
InChI=1S/C29H31N3/c1-6-30-28-20-19-27(25-9-7-8-10-26(25)28)29(21-11-15-23(16-12-21)31(2)3)22-13-17-24(18-14-22)32(4)5/h7-20H,6H2,1-5H3
InChIKey
ARNURRQQSTYLEY-UHFFFAOYSA-N
Compound name
4-[[4-(dimethylamino)phenyl]-(4-ethyliminonaphthalen-1-ylidene)methyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

10
References

7422
Patents

421.2518 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 422.25908 208.6
[M+Na]+ 444.24102 212.0
[M-H]- 420.24452 221.5
[M+NH4]+ 439.28562 219.8
[M+K]+ 460.21496 206.9
[M+H-H2O]+ 404.24906 196.4
[M+HCOO]- 466.25000 231.7
[M+CH3COO]- 480.26565 246.8
[M+Na-2H]- 442.22647 209.1
[M]+ 421.25125 208.6
[M]- 421.25235 208.6
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.