CID 54595741

{[3-(1-ethoxyethyl)-1,2,4-oxadiazol-5-yl]methyl}(methyl)amine

Structural Information

Molecular Formula
C8H15N3O2
SMILES
CCOC(C)C1=NOC(=N1)CNC
InChI
InChI=1S/C8H15N3O2/c1-4-12-6(2)8-10-7(5-9-3)13-11-8/h6,9H,4-5H2,1-3H3
InChIKey
XWAQCKUMXUNYHW-UHFFFAOYSA-N
Compound name
1-[3-(1-ethoxyethyl)-1,2,4-oxadiazol-5-yl]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.11642 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.123696 141.0
[M+Na]+ 208.105638 148.5
[M-H]- 184.109144 142.6
[M+NH4]+ 203.150243 158.5
[M+K]+ 224.079578 149.1
[M+H-H2O]+ 168.113680 133.4
[M+HCOO]- 230.114621 163.5
[M+CH3COO]- 244.130271 184.6
[M+Na-2H]- 206.091086 146.5
[M]+ 185.11587142 144.7
[M]- 185.11696858 144.7
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

No patent data available for this compound.