CID 165945519

2703778-73-6

Structural Information

Molecular Formula
C7H11F2N3
SMILES
C1CNCCC1C2(N=N2)C(F)F
InChI
InChI=1S/C7H11F2N3/c8-6(9)7(11-12-7)5-1-3-10-4-2-5/h5-6,10H,1-4H2
InChIKey
UNSFCMKKOMOZKX-UHFFFAOYSA-N
Compound name
4-[3-(difluoromethyl)diazirin-3-yl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.0921 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.09938 142.0
[M+Na]+ 198.08132 150.3
[M-H]- 174.08482 141.1
[M+NH4]+ 193.12592 154.1
[M+K]+ 214.05526 147.2
[M+H-H2O]+ 158.08936 132.2
[M+HCOO]- 220.09030 156.3
[M+CH3COO]- 234.10595 179.6
[M+Na-2H]- 196.06677 147.2
[M]+ 175.09155 136.6
[M]- 175.09265 136.7
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.