CID 75481046

5-(chloromethyl)-n,n-dimethyl-1,2,4-oxadiazol-3-amine

Structural Information

Molecular Formula
C5H8ClN3O
SMILES
CN(C)C1=NOC(=N1)CCl
InChI
InChI=1S/C5H8ClN3O/c1-9(2)5-7-4(3-6)10-8-5/h3H2,1-2H3
InChIKey
SOPQEQPJQATWPO-UHFFFAOYSA-N
Compound name
5-(chloromethyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.03558 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.04286 129.3
[M+Na]+ 184.02480 141.5
[M+NH4]+ 179.06940 137.4
[M+K]+ 199.99874 138.2
[M-H]- 160.02830 131.5
[M+Na-2H]- 182.01025 135.1
[M]+ 161.03503 131.8
[M]- 161.03613 131.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.