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

3
Patents

185.11642 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.12370 140.8
[M+Na]+ 208.10564 145.9
[M-H]- 184.10914 144.6
[M+NH4]+ 203.15024 155.9
[M+K]+ 224.07958 146.6
[M+H-H2O]+ 168.11368 132.6
[M+HCOO]- 230.11462 158.4
[M+CH3COO]- 244.13027 180.3
[M+Na-2H]- 206.09109 145.3
[M]+ 185.11587 136.5
[M]- 185.11697 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

No patent data available for this compound.