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

5
Patents

163.04001 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04729 131.0
[M+Na]+ 186.02923 138.4
[M-H]- 162.03273 133.4
[M+NH4]+ 181.07383 149.9
[M+K]+ 202.00317 137.7
[M+H-H2O]+ 146.03727 125.8
[M+HCOO]- 208.03821 145.0
[M+CH3COO]- 222.05386 174.3
[M+Na-2H]- 184.01468 136.4
[M]+ 163.03946 130.3
[M]- 163.04056 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