CID 5897949

18432-30-9

Structural Information

Molecular Formula
C22H18N2O2
SMILES
CN(C)C1=CC=C(C=C1)/C=C\2/C3=CC=CC=C3C4=C2C=C(C=C4)[N+](=O)[O-]
InChI
InChI=1S/C22H18N2O2/c1-23(2)16-9-7-15(8-10-16)13-21-19-6-4-3-5-18(19)20-12-11-17(24(25)26)14-22(20)21/h3-14H,1-2H3/b21-13-
InChIKey
XMNXSUPJEJGSMD-BKUYFWCQSA-N
Compound name
N,N-dimethyl-4-[(Z)-(2-nitrofluoren-9-ylidene)methyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.13684 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.144116 181.8
[M+Na]+ 365.126058 188.1
[M-H]- 341.129564 191.6
[M+NH4]+ 360.170663 198.0
[M+K]+ 381.099998 178.6
[M+H-H2O]+ 325.134100 177.5
[M+HCOO]- 387.135041 205.9
[M+CH3COO]- 401.150691 214.0
[M+Na-2H]- 363.111506 186.8
[M]+ 342.13629142 181.6
[M]- 342.13738858 181.6
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.