CID 10057542

6-(aminomethyl)morpholin-3-one hydrochloride

Structural Information

Molecular Formula
C5H10N2O2
SMILES
C1C(OCC(=O)N1)CN
InChI
InChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)3-9-4/h4H,1-3,6H2,(H,7,8)
InChIKey
RRAANKOMZXHCIN-UHFFFAOYSA-N
Compound name
6-(aminomethyl)morpholin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

130.07423 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.08151 126.3
[M+Na]+ 153.06345 132.2
[M-H]- 129.06695 126.9
[M+NH4]+ 148.10805 144.2
[M+K]+ 169.03739 131.8
[M+H-H2O]+ 113.07149 120.1
[M+HCOO]- 175.07243 145.0
[M+CH3COO]- 189.08808 168.8
[M+Na-2H]- 151.04890 132.5
[M]+ 130.07368 120.4
[M]- 130.07478 120.4
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