CID 38976

Carbazole, 3-fluoro-9-(2-pyrrolidinoethyl)-, oxalate

Structural Information

Molecular Formula
C18H19FN2
SMILES
C1CCN(C1)CCN2C3=C(C=C(C=C3)F)C4=CC=CC=C42
InChI
InChI=1S/C18H19FN2/c19-14-7-8-18-16(13-14)15-5-1-2-6-17(15)21(18)12-11-20-9-3-4-10-20/h1-2,5-8,13H,3-4,9-12H2
InChIKey
KUMLZNYJDXLLAM-UHFFFAOYSA-N
Compound name
3-fluoro-9-(2-pyrrolidin-1-ylethyl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.15323 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.16051 165.6
[M+Na]+ 305.14245 174.9
[M-H]- 281.14595 170.5
[M+NH4]+ 300.18705 184.6
[M+K]+ 321.11639 168.4
[M+H-H2O]+ 265.15049 156.2
[M+HCOO]- 327.15143 184.7
[M+CH3COO]- 341.16708 177.2
[M+Na-2H]- 303.12790 167.4
[M]+ 282.15268 165.0
[M]- 282.15378 165.0
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.