CID 387533

Nsc681443

Structural Information

Molecular Formula
C8H15N3O2
SMILES
C1COCCN1CC2CN=C(O2)N
InChI
InChI=1S/C8H15N3O2/c9-8-10-5-7(13-8)6-11-1-3-12-4-2-11/h7H,1-6H2,(H2,9,10)
InChIKey
YCRRUOJUYLAPSS-UHFFFAOYSA-N
Compound name
5-(morpholin-4-ylmethyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

185.11642 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.123696 140.8
[M+Na]+ 208.105638 145.9
[M-H]- 184.109144 144.6
[M+NH4]+ 203.150243 155.9
[M+K]+ 224.079578 146.6
[M+H-H2O]+ 168.113680 132.6
[M+HCOO]- 230.114621 158.4
[M+CH3COO]- 244.130271 180.3
[M+Na-2H]- 206.091086 145.3
[M]+ 185.11587142 136.5
[M]- 185.11696858 136.5
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