CID 118185512

2411305-91-2

Structural Information

Molecular Formula
C7H12FN
SMILES
CC1(CC2(C1)CNC2)F
InChI
InChI=1S/C7H12FN/c1-6(8)2-7(3-6)4-9-5-7/h9H,2-5H2,1H3
InChIKey
DHTPDDPSFLPEPS-UHFFFAOYSA-N
Compound name
6-fluoro-6-methyl-2-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

129.09538 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.10266 123.9
[M+Na]+ 152.08460 129.8
[M-H]- 128.08810 126.3
[M+NH4]+ 147.12920 134.8
[M+K]+ 168.05854 133.0
[M+H-H2O]+ 112.09264 111.8
[M+HCOO]- 174.09358 139.6
[M+CH3COO]- 188.10923 182.7
[M+Na-2H]- 150.07005 131.1
[M]+ 129.09483 135.7
[M]- 129.09593 135.7
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

patents stripe