CID 121199384

4-(fluoromethyl)-2-azaspiro[4.4]nonane

Structural Information

Molecular Formula
C9H16FN
SMILES
C1CCC2(C1)CNCC2CF
InChI
InChI=1S/C9H16FN/c10-5-8-6-11-7-9(8)3-1-2-4-9/h8,11H,1-7H2
InChIKey
ZBMQGJHVUIOGPE-UHFFFAOYSA-N
Compound name
4-(fluoromethyl)-2-azaspiro[4.4]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.12668 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.13396 136.6
[M+Na]+ 180.11590 142.3
[M-H]- 156.11940 137.6
[M+NH4]+ 175.16050 160.9
[M+K]+ 196.08984 139.6
[M+H-H2O]+ 140.12394 129.9
[M+HCOO]- 202.12488 154.5
[M+CH3COO]- 216.14053 148.5
[M+Na-2H]- 178.10135 138.6
[M]+ 157.12613 128.2
[M]- 157.12723 128.2
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.