CID 45423

63918-45-6

Structural Information

Molecular Formula
C25H33NO2
SMILES
CCCCN(CCCC)CCCOC(=O)C1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C25H33NO2/c1-3-5-16-26(17-6-4-2)18-11-19-28-25(27)24-22-14-9-7-12-20(22)21-13-8-10-15-23(21)24/h7-10,12-15,24H,3-6,11,16-19H2,1-2H3
InChIKey
MHGGWVJWROZEPS-UHFFFAOYSA-N
Compound name
3-(dibutylamino)propyl 9H-fluorene-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.25113 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.258406 199.9
[M+Na]+ 402.240348 203.6
[M-H]- 378.243854 204.9
[M+NH4]+ 397.284953 215.8
[M+K]+ 418.214288 198.9
[M+H-H2O]+ 362.248390 191.2
[M+HCOO]- 424.249331 220.2
[M+CH3COO]- 438.264981 227.9
[M+Na-2H]- 400.225796 199.8
[M]+ 379.25058142 206.0
[M]- 379.25167858 206.0
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.