CID 229536

102241-35-0

Structural Information

Molecular Formula
C21H16N2O2
SMILES
CCC1=CC=C(C=C1)N=C2C3=CC=CC=C3C4=C2C=C(C=C4)[N+](=O)[O-]
InChI
InChI=1S/C21H16N2O2/c1-2-14-7-9-15(10-8-14)22-21-19-6-4-3-5-17(19)18-12-11-16(23(24)25)13-20(18)21/h3-13H,2H2,1H3
InChIKey
FRPKQMMWQYKMQP-UHFFFAOYSA-N
Compound name
N-(4-ethylphenyl)-2-nitrofluoren-9-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.1212 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.12848 177.0
[M+Na]+ 351.11042 184.2
[M-H]- 327.11392 187.0
[M+NH4]+ 346.15502 194.0
[M+K]+ 367.08436 174.4
[M+H-H2O]+ 311.11846 172.8
[M+HCOO]- 373.11940 202.5
[M+CH3COO]- 387.13505 210.4
[M+Na-2H]- 349.09587 183.7
[M]+ 328.12065 177.2
[M]- 328.12175 177.2
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.