CID 72699150

7-methyl-5-oxa-2,7-diazaspiro[3.4]octan-6-one hydrochloride

Structural Information

Molecular Formula
C6H10N2O2
SMILES
CN1CC2(CNC2)OC1=O
InChI
InChI=1S/C6H10N2O2/c1-8-4-6(2-7-3-6)10-5(8)9/h7H,2-4H2,1H3
InChIKey
RUNNPHJFVKWZFO-UHFFFAOYSA-N
Compound name
7-methyl-5-oxa-2,7-diazaspiro[3.4]octan-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

142.07423 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.08151 122.8
[M+Na]+ 165.06345 129.8
[M-H]- 141.06695 125.3
[M+NH4]+ 160.10805 137.4
[M+K]+ 181.03739 132.4
[M+H-H2O]+ 125.07149 113.0
[M+HCOO]- 187.07243 140.2
[M+CH3COO]- 201.08808 171.9
[M+Na-2H]- 163.04890 129.3
[M]+ 142.07368 128.7
[M]- 142.07478 128.7
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