CID 23448142

4-(difluoromethylidene)piperidine hydrochloride

Structural Information

Molecular Formula
C6H9F2N
SMILES
C1CNCCC1=C(F)F
InChI
InChI=1S/C6H9F2N/c7-6(8)5-1-3-9-4-2-5/h9H,1-4H2
InChIKey
WVIJOUFQYFUXAY-UHFFFAOYSA-N
Compound name
4-(difluoromethylidene)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

133.07031 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.077586 125.8
[M+Na]+ 156.059528 131.1
[M-H]- 132.063034 123.1
[M+NH4]+ 151.104133 145.2
[M+K]+ 172.033468 128.7
[M+H-H2O]+ 116.067570 118.2
[M+HCOO]- 178.068511 141.2
[M+CH3COO]- 192.084161 168.1
[M+Na-2H]- 154.044976 129.6
[M]+ 133.06976142 115.1
[M]- 133.07085858 115.1
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

patents stripe