CID 363698

9h-fluorene, 9-(dinitromethylene)-

Structural Information

Molecular Formula
C14H8N2O4
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C2=C([N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C14H8N2O4/c17-15(18)14(16(19)20)13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H
InChIKey
LXCXLWVHPCFEEP-UHFFFAOYSA-N
Compound name
9-(dinitromethylidene)fluorene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.0484 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.05568 158.6
[M+Na]+ 291.03762 164.0
[M-H]- 267.04112 163.8
[M+NH4]+ 286.08222 175.8
[M+K]+ 307.01156 152.4
[M+H-H2O]+ 251.04566 160.9
[M+HCOO]- 313.04660 181.9
[M+CH3COO]- 327.06225 186.8
[M+Na-2H]- 289.02307 167.3
[M]+ 268.04785 155.0
[M]- 268.04895 155.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.