CID 84065206

2613382-92-4

Structural Information

Molecular Formula
C8H15NO3
SMILES
COC(=O)CCC1CNCCO1
InChI
InChI=1S/C8H15NO3/c1-11-8(10)3-2-7-6-9-4-5-12-7/h7,9H,2-6H2,1H3
InChIKey
RYXRCGIYXJMBJQ-UHFFFAOYSA-N
Compound name
methyl 3-morpholin-2-ylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

173.1052 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 138.7
[M+Na]+ 196.09442 143.0
[M-H]- 172.09792 139.1
[M+NH4]+ 191.13902 155.2
[M+K]+ 212.06836 143.4
[M+H-H2O]+ 156.10246 132.1
[M+HCOO]- 218.10340 155.4
[M+CH3COO]- 232.11905 174.8
[M+Na-2H]- 194.07987 143.6
[M]+ 173.10465 136.1
[M]- 173.10575 136.1
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