CID 82418847

2306277-85-8

Structural Information

Molecular Formula
C7H11NO
SMILES
C1CNC2(CC2)CC1=O
InChI
InChI=1S/C7H11NO/c9-6-1-4-8-7(5-6)2-3-7/h8H,1-5H2
InChIKey
RUDKHYCQERSGGC-UHFFFAOYSA-N
Compound name
4-azaspiro[2.5]octan-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

125.08406 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.091336 130.6
[M+Na]+ 148.073278 139.1
[M-H]- 124.076784 134.3
[M+NH4]+ 143.117883 148.0
[M+K]+ 164.047218 137.0
[M+H-H2O]+ 108.081320 124.9
[M+HCOO]- 170.082261 149.2
[M+CH3COO]- 184.097911 169.9
[M+Na-2H]- 146.058726 137.9
[M]+ 125.08351142 127.3
[M]- 125.08460858 127.3
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