CID 155819853

(3s)-3-methyl-2-azaspiro[4.4]nonan-1-one

Structural Information

Molecular Formula
C9H15NO
SMILES
C[C@H]1CC2(CCCC2)C(=O)N1
InChI
InChI=1S/C9H15NO/c1-7-6-9(8(11)10-7)4-2-3-5-9/h7H,2-6H2,1H3,(H,10,11)/t7-/m0/s1
InChIKey
NKQHQKRZLIPLTP-ZETCQYMHSA-N
Compound name
(3S)-3-methyl-2-azaspiro[4.4]nonan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 135.7
[M+Na]+ 176.10459 142.6
[M-H]- 152.10809 138.5
[M+NH4]+ 171.14919 160.5
[M+K]+ 192.07853 140.1
[M+H-H2O]+ 136.11263 130.6
[M+HCOO]- 198.11357 155.0
[M+CH3COO]- 212.12922 171.0
[M+Na-2H]- 174.09004 137.8
[M]+ 153.11482 129.6
[M]- 153.11592 129.6
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.