CID 15955

1914-42-7

Structural Information

Molecular Formula
C16H11Cl4NO2
SMILES
CCOC(=O)NC1=C(C2=C(C3=C(C2)C=C(C=C3)Cl)C(=C1Cl)Cl)Cl
InChI
InChI=1S/C16H11Cl4NO2/c1-2-23-16(22)21-15-12(18)10-6-7-5-8(17)3-4-9(7)11(10)13(19)14(15)20/h3-5H,2,6H2,1H3,(H,21,22)
InChIKey
VXDOUSCYWPUBGZ-UHFFFAOYSA-N
Compound name
ethyl N-(1,3,4,7-tetrachloro-9H-fluoren-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.95438 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.96166 185.4
[M+Na]+ 411.94360 197.4
[M-H]- 387.94710 188.1
[M+NH4]+ 406.98820 202.5
[M+K]+ 427.91754 190.1
[M+H-H2O]+ 371.95164 182.3
[M+HCOO]- 433.95258 187.8
[M+CH3COO]- 447.96823 195.2
[M+Na-2H]- 409.92905 184.6
[M]+ 388.95383 191.8
[M]- 388.95493 191.8
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.