CID 71758100

5-(aminomethyl)-n,n-dimethyloxolane-2-carboxamide hydrochloride

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CN(C)C(=O)C1CCC(O1)CN
InChI
InChI=1S/C8H16N2O2/c1-10(2)8(11)7-4-3-6(5-9)12-7/h6-7H,3-5,9H2,1-2H3
InChIKey
BKFIAAKZWQTGHE-UHFFFAOYSA-N
Compound name
5-(aminomethyl)-N,N-dimethyloxolane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

172.12119 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 140.2
[M+Na]+ 195.11041 145.2
[M-H]- 171.11391 145.0
[M+NH4]+ 190.15501 160.7
[M+K]+ 211.08435 146.8
[M+H-H2O]+ 155.11845 134.1
[M+HCOO]- 217.11939 163.4
[M+CH3COO]- 231.13504 186.2
[M+Na-2H]- 193.09586 142.4
[M]+ 172.12064 138.6
[M]- 172.12174 138.6
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

patents stripe