CID 39307

42839-73-6

Structural Information

Molecular Formula
C19H20BrNO2
SMILES
CCN(CC)CC1=C2C3=CC=CC=C3C(=O)C2=C(C=C1OC)Br
InChI
InChI=1S/C19H20BrNO2/c1-4-21(5-2)11-14-16(23-3)10-15(20)18-17(14)12-8-6-7-9-13(12)19(18)22/h6-10H,4-5,11H2,1-3H3
InChIKey
XZKXFZSASKXDBB-UHFFFAOYSA-N
Compound name
1-bromo-4-(diethylaminomethyl)-3-methoxyfluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

373.06775 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.07503 184.7
[M+Na]+ 396.05697 196.6
[M-H]- 372.06047 194.0
[M+NH4]+ 391.10157 205.3
[M+K]+ 412.03091 184.9
[M+H-H2O]+ 356.06501 183.5
[M+HCOO]- 418.06595 205.4
[M+CH3COO]- 432.08160 221.3
[M+Na-2H]- 394.04242 187.6
[M]+ 373.06720 208.6
[M]- 373.06830 208.6
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

No patent data available for this compound.