CID 14858456

[(morpholin-3-ylidene)amino]formonitrile

Structural Information

Molecular Formula
C5H7N3O
SMILES
C1COCC(=N1)NC#N
InChI
InChI=1S/C5H7N3O/c6-4-8-5-3-9-2-1-7-5/h1-3H2,(H,7,8)
InChIKey
OWGCMGRMXGZOLM-UHFFFAOYSA-N
Compound name
3,6-dihydro-2H-1,4-oxazin-5-ylcyanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

125.058914 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.066190 120.6
[M+Na]+ 148.048132 128.7
[M-H]- 124.051638 122.4
[M+NH4]+ 143.092737 137.5
[M+K]+ 164.022072 128.7
[M+H-H2O]+ 108.056174 107.3
[M+HCOO]- 170.057115 139.0
[M+CH3COO]- 184.072765 183.3
[M+Na-2H]- 146.033580 129.7
[M]+ 125.05836542 113.0
[M]- 125.05946258 113.0
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

patents stripe