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]+ 343.14412 181.8
[M+Na]+ 365.12606 188.1
[M-H]- 341.12956 191.6
[M+NH4]+ 360.17066 198.0
[M+K]+ 381.10000 178.6
[M+H-H2O]+ 325.13410 177.5
[M+HCOO]- 387.13504 205.9
[M+CH3COO]- 401.15069 214.0
[M+Na-2H]- 363.11151 186.8
[M]+ 342.13629 181.6
[M]- 342.13739 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.