CID 85775984

(9h-fluoren-9-yl)methyln-(chlorosulfonyl)carbamate

Structural Information

Molecular Formula
C15H12ClNO4S
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NS(=O)(=O)Cl
InChI
InChI=1S/C15H12ClNO4S/c16-22(19,20)17-15(18)21-9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14H,9H2,(H,17,18)
InChIKey
BSXMXCTWIRNTJY-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl N-chlorosulfonylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

337.01755 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.02483 171.8
[M+Na]+ 360.00677 183.6
[M+NH4]+ 355.05137 179.9
[M+K]+ 375.98071 177.0
[M-H]- 336.01027 173.4
[M+Na-2H]- 357.99222 176.5
[M]+ 337.01700 174.6
[M]- 337.01810 174.6
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

patents stripe