CID 146049575

2411265-54-6

Structural Information

Molecular Formula
C7H11F2N
SMILES
C1C(CC12CNC2)C(F)F
InChI
InChI=1S/C7H11F2N/c8-6(9)5-1-7(2-5)3-10-4-7/h5-6,10H,1-4H2
InChIKey
WKMUQHDSDUKPLI-UHFFFAOYSA-N
Compound name
6-(difluoromethyl)-2-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

147.08595 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.09323 127.0
[M+Na]+ 170.07517 131.7
[M-H]- 146.07867 127.7
[M+NH4]+ 165.11977 135.2
[M+K]+ 186.04911 135.1
[M+H-H2O]+ 130.08321 112.4
[M+HCOO]- 192.08415 140.8
[M+CH3COO]- 206.09980 186.0
[M+Na-2H]- 168.06062 131.5
[M]+ 147.08540 136.7
[M]- 147.08650 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.