CID 79887428

2-methylmorpholine-4-carbonyl chloride

Structural Information

Molecular Formula
C6H10ClNO2
SMILES
CC1CN(CCO1)C(=O)Cl
InChI
InChI=1S/C6H10ClNO2/c1-5-4-8(6(7)9)2-3-10-5/h5H,2-4H2,1H3
InChIKey
RYAYGDDXNUGATM-UHFFFAOYSA-N
Compound name
2-methylmorpholine-4-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

163.04001 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.047286 131.0
[M+Na]+ 186.029228 138.4
[M-H]- 162.032734 133.4
[M+NH4]+ 181.073833 149.9
[M+K]+ 202.003168 137.7
[M+H-H2O]+ 146.037270 125.8
[M+HCOO]- 208.038211 145.0
[M+CH3COO]- 222.053861 174.3
[M+Na-2H]- 184.014676 136.4
[M]+ 163.03946142 130.3
[M]- 163.04055858 130.3
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