CID 10630733

1,4-diazaspiro[5.5]undecane

Structural Information

Molecular Formula
C9H18N2
SMILES
C1CCC2(CC1)CNCCN2
InChI
InChI=1S/C9H18N2/c1-2-4-9(5-3-1)8-10-6-7-11-9/h10-11H,1-8H2
InChIKey
VVBIFWHTQJEQQD-UHFFFAOYSA-N
Compound name
1,4-diazaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

154.147 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.154276 138.7
[M+Na]+ 177.136218 141.0
[M-H]- 153.139724 137.0
[M+NH4]+ 172.180823 156.9
[M+K]+ 193.110158 137.7
[M+H-H2O]+ 137.144260 131.1
[M+HCOO]- 199.145201 150.3
[M+CH3COO]- 213.160851 147.9
[M+Na-2H]- 175.121666 144.4
[M]+ 154.14645142 125.3
[M]- 154.14754858 125.3
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

patents stripe