CID 21037007

1023305-87-4

Structural Information

Molecular Formula
C6H12FN
SMILES
CC1(CCNCC1)F
InChI
InChI=1S/C6H12FN/c1-6(7)2-4-8-5-3-6/h8H,2-5H2,1H3
InChIKey
JLXVITLYWGUPQP-UHFFFAOYSA-N
Compound name
4-fluoro-4-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

177
Patents

117.095375 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.102651 123.8
[M+Na]+ 140.084593 129.8
[M-H]- 116.088099 122.8
[M+NH4]+ 135.129198 146.0
[M+K]+ 156.058533 128.4
[M+H-H2O]+ 100.092635 117.9
[M+HCOO]- 162.093576 141.1
[M+CH3COO]- 176.109226 165.6
[M+Na-2H]- 138.070041 130.5
[M]+ 117.09482642 116.0
[M]- 117.09592358 116.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe