CID 135755729

Brn 0616709

Structural Information

Molecular Formula
C14H19N3O2
SMILES
CCN(CC)CCC1=NC(=NO1)C2=CC=C(C=C2)O
InChI
InChI=1S/C14H19N3O2/c1-3-17(4-2)10-9-13-15-14(16-19-13)11-5-7-12(18)8-6-11/h5-8,18H,3-4,9-10H2,1-2H3
InChIKey
BUSRSWRLJGDITE-UHFFFAOYSA-N
Compound name
4-[5-[2-(diethylamino)ethyl]-1,2,4-oxadiazol-3-yl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.14774 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.15502 161.3
[M+Na]+ 284.13696 173.3
[M+NH4]+ 279.18156 168.0
[M+K]+ 300.11090 169.4
[M-H]- 260.14046 165.2
[M+Na-2H]- 282.12241 167.6
[M]+ 261.14719 164.0
[M]- 261.14829 164.0
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.