CID 10397232

2-(morpholinomethyl)acrylic acid

Structural Information

Molecular Formula

C₈H₁₃NO₃

SMILES

C=C(CN1CCOCC1)C(=O)O

InChI

InChI=1S/C8H13NO3/c1-7(8(10)11)6-9-2-4-12-5-3-9/h1-6H2,(H,10,11)

InChIKey

IGZSSKAOSOCVPH-UHFFFAOYSA-N

Compound name

2-(morpholin-4-ylmethyl)prop-2-enoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 87
Patents: 171.08954 Da
Monoisotopic Mass: -2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	172.09682	137.8
[M+Na]+	194.07876	146.8
[M+NH4]+	189.12336	144.2
[M+K]+	210.05270	143.3
[M-H]-	170.08226	138.1
[M+Na-2H]-	192.06421	140.2
[M]+	171.08899	138.7
[M]-	171.09009	138.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe