CID 121552832

3-(propan-2-yl)-2-azaspiro[3.4]octan-1-one

Structural Information

Molecular Formula
C10H17NO
SMILES
CC(C)C1C2(CCCC2)C(=O)N1
InChI
InChI=1S/C10H17NO/c1-7(2)8-10(9(12)11-8)5-3-4-6-10/h7-8H,3-6H2,1-2H3,(H,11,12)
InChIKey
GQLVLYDHEIOTQD-UHFFFAOYSA-N
Compound name
1-propan-2-yl-2-azaspiro[3.4]octan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.138286 138.0
[M+Na]+ 190.120228 143.1
[M-H]- 166.123734 140.8
[M+NH4]+ 185.164833 154.1
[M+K]+ 206.094168 143.7
[M+H-H2O]+ 150.128270 128.5
[M+HCOO]- 212.129211 154.9
[M+CH3COO]- 226.144861 179.8
[M+Na-2H]- 188.105676 140.1
[M]+ 167.13046142 142.0
[M]- 167.13155858 142.0
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.