CID 32942

25389-42-8

Structural Information

Molecular Formula
C22H27NO2
SMILES
CCC1(C2=CC=CC=C2C3=CC=CC=C31)C(=O)OCCN(CC)CC
InChI
InChI=1S/C22H27NO2/c1-4-22(21(24)25-16-15-23(5-2)6-3)19-13-9-7-11-17(19)18-12-8-10-14-20(18)22/h7-14H,4-6,15-16H2,1-3H3
InChIKey
IMXRUEKSWQADJK-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl 9-ethylfluorene-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.2042 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.211476 185.6
[M+Na]+ 360.193418 192.0
[M-H]- 336.196924 191.7
[M+NH4]+ 355.238023 205.5
[M+K]+ 376.167358 188.0
[M+H-H2O]+ 320.201460 178.1
[M+HCOO]- 382.202401 207.2
[M+CH3COO]- 396.218051 218.6
[M+Na-2H]- 358.178866 188.4
[M]+ 337.20365142 191.2
[M]- 337.20474858 191.2
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.