CID 167716550

2297378-74-4

Structural Information

Molecular Formula
C9H16N2O
SMILES
C1CC2(CCC1CN)CC(=O)N2
InChI
InChI=1S/C9H16N2O/c10-6-7-1-3-9(4-2-7)5-8(12)11-9/h7H,1-6,10H2,(H,11,12)
InChIKey
KXWLJIPTTTZWMB-UHFFFAOYSA-N
Compound name
7-(aminomethyl)-1-azaspiro[3.5]nonan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.12627 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.13355 140.4
[M+Na]+ 191.11549 144.9
[M+NH4]+ 186.16009 145.7
[M+K]+ 207.08943 139.7
[M-H]- 167.11899 139.3
[M+Na-2H]- 189.10094 142.9
[M]+ 168.12572 139.3
[M]- 168.12682 139.3
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.