CID 39309

Brn 2135464

Structural Information

Molecular Formula
C19H21NO2
SMILES
CCN(CC)CC1=CC2=C(C=C1OC)C3=CC=CC=C3C2=O
InChI
InChI=1S/C19H21NO2/c1-4-20(5-2)12-13-10-17-16(11-18(13)22-3)14-8-6-7-9-15(14)19(17)21/h6-11H,4-5,12H2,1-3H3
InChIKey
ASJXUARCQZTTEE-UHFFFAOYSA-N
Compound name
2-(diethylaminomethyl)-3-methoxyfluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.15723 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.16451 170.4
[M+Na]+ 318.14645 179.1
[M-H]- 294.14995 177.5
[M+NH4]+ 313.19105 190.6
[M+K]+ 334.12039 175.3
[M+H-H2O]+ 278.15449 163.4
[M+HCOO]- 340.15543 194.0
[M+CH3COO]- 354.17108 212.5
[M+Na-2H]- 316.13190 173.6
[M]+ 295.15668 176.2
[M]- 295.15778 176.2
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.