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

119
Patents

133.07031 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07759 125.8
[M+Na]+ 156.05953 131.1
[M-H]- 132.06303 123.1
[M+NH4]+ 151.10413 145.2
[M+K]+ 172.03347 128.7
[M+H-H2O]+ 116.06757 118.2
[M+HCOO]- 178.06851 141.2
[M+CH3COO]- 192.08416 168.1
[M+Na-2H]- 154.04498 129.6
[M]+ 133.06976 115.1
[M]- 133.07086 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