CID 15953920

1-phenyl-ethanone o-(5-morpholin-4-yl-[1,3,4]oxadiazol-2-ylmethyl)-oxime

Structural Information

Molecular Formula
C15H18N4O3
SMILES
C/C(=N\OCC1=NN=C(O1)N2CCOCC2)/C3=CC=CC=C3
InChI
InChI=1S/C15H18N4O3/c1-12(13-5-3-2-4-6-13)18-21-11-14-16-17-15(22-14)19-7-9-20-10-8-19/h2-6H,7-11H2,1H3/b18-12+
InChIKey
IWHFJLWMHYVCOU-LDADJPATSA-N
Compound name
(E)-N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1-phenylethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.13788 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.14516 169.4
[M+Na]+ 325.12710 174.2
[M-H]- 301.13060 176.8
[M+NH4]+ 320.17170 178.6
[M+K]+ 341.10104 173.8
[M+H-H2O]+ 285.13514 158.2
[M+HCOO]- 347.13608 187.6
[M+CH3COO]- 361.15173 179.5
[M+Na-2H]- 323.11255 173.5
[M]+ 302.13733 169.6
[M]- 302.13843 169.6
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

No patent data available for this compound.