CID 12150106

Methyl 2-(morpholin-2-yl)acetate hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
COC(=O)CC1CNCCO1
InChI
InChI=1S/C7H13NO3/c1-10-7(9)4-6-5-8-2-3-11-6/h6,8H,2-5H2,1H3
InChIKey
PVCYXJXAUBLSJG-UHFFFAOYSA-N
Compound name
methyl 2-morpholin-2-ylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

159.08954 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09682 134.1
[M+Na]+ 182.07876 138.9
[M-H]- 158.08226 134.7
[M+NH4]+ 177.12336 151.2
[M+K]+ 198.05270 139.5
[M+H-H2O]+ 142.08680 127.7
[M+HCOO]- 204.08774 151.1
[M+CH3COO]- 218.10339 171.7
[M+Na-2H]- 180.06421 139.5
[M]+ 159.08899 131.1
[M]- 159.09009 131.1
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