CID 20277171

7-azaspiro[3.5]nonane

Structural Information

Molecular Formula
C8H15N
SMILES
C1CC2(C1)CCNCC2
InChI
InChI=1S/C8H15N/c1-2-8(3-1)4-6-9-7-5-8/h9H,1-7H2
InChIKey
BSQKGAVROUDOTE-UHFFFAOYSA-N
Compound name
7-azaspiro[3.5]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1799
Patents

125.12045 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 125.1
[M+Na]+ 148.109668 128.9
[M-H]- 124.113174 127.2
[M+NH4]+ 143.154273 140.8
[M+K]+ 164.083608 129.9
[M+H-H2O]+ 108.117710 114.9
[M+HCOO]- 170.118651 141.4
[M+CH3COO]- 184.134301 170.3
[M+Na-2H]- 146.095116 132.5
[M]+ 125.11990142 125.7
[M]- 125.12099858 125.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe