CID 115102

107474-79-3

Structural Information

Molecular Formula
C16H13ClO2
SMILES
CC(C1C2=CC=CC=C2C3=CC=CC=C13)OC(=O)Cl
InChI
InChI=1S/C16H13ClO2/c1-10(19-16(17)18)15-13-8-4-2-6-11(13)12-7-3-5-9-14(12)15/h2-10,15H,1H3
InChIKey
SFRVOKMRHPQYGE-UHFFFAOYSA-N
Compound name
1-(9H-fluoren-9-yl)ethyl carbonochloridate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

30
References

169
Patents

272.0604 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.06768 161.0
[M+Na]+ 295.04962 170.5
[M-H]- 271.05312 166.6
[M+NH4]+ 290.09422 182.2
[M+K]+ 311.02356 165.1
[M+H-H2O]+ 255.05766 155.7
[M+HCOO]- 317.05860 177.7
[M+CH3COO]- 331.07425 173.8
[M+Na-2H]- 293.03507 164.6
[M]+ 272.05985 165.5
[M]- 272.06095 165.5
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

patents stripe