CID 125511923

1954361-13-7

Structural Information

Molecular Formula
C9H13NO
SMILES
C1CN2CCC1C(=O)C23CC3
InChI
InChI=1S/C9H13NO/c11-8-7-1-5-10(6-2-7)9(8)3-4-9/h7H,1-6H2
InChIKey
SZXBFHCOJLDTNH-UHFFFAOYSA-N
Compound name
spiro[1-azabicyclo[2.2.2]octane-2,1'-cyclopropane]-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

151.09972 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.10700 138.2
[M+Na]+ 174.08894 146.0
[M-H]- 150.09244 137.6
[M+NH4]+ 169.13354 159.1
[M+K]+ 190.06288 142.8
[M+H-H2O]+ 134.09698 131.7
[M+HCOO]- 196.09792 148.9
[M+CH3COO]- 210.11357 149.1
[M+Na-2H]- 172.07439 149.5
[M]+ 151.09917 140.3
[M]- 151.10027 140.3
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