CID 15372180

1-(4-fluorophenyl)pyrrolidine

Structural Information

Molecular Formula
C10H12FN
SMILES
C1CCN(C1)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H12FN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h3-6H,1-2,7-8H2
InChIKey
IIYRJYZDFOBAKW-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

165.09538 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.10266 136.5
[M+Na]+ 188.08460 148.5
[M+NH4]+ 183.12920 145.7
[M+K]+ 204.05854 142.8
[M-H]- 164.08810 139.0
[M+Na-2H]- 186.07005 143.9
[M]+ 165.09483 138.8
[M]- 165.09593 138.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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