CID 370774

4-hydroxy-n-methoxy-n-methylbutanamide

Structural Information

Molecular Formula
C6H13NO3
SMILES
CN(C(=O)CCCO)OC
InChI
InChI=1S/C6H13NO3/c1-7(10-2)6(9)4-3-5-8/h8H,3-5H2,1-2H3
InChIKey
AIKUJZQXDGQFOR-UHFFFAOYSA-N
Compound name
4-hydroxy-N-methoxy-N-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

147.08954 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.096816 131.3
[M+Na]+ 170.078758 137.5
[M-H]- 146.082264 131.7
[M+NH4]+ 165.123363 152.4
[M+K]+ 186.052698 139.0
[M+H-H2O]+ 130.086800 126.2
[M+HCOO]- 192.087741 155.1
[M+CH3COO]- 206.103391 178.1
[M+Na-2H]- 168.064206 136.1
[M]+ 147.08899142 134.0
[M]- 147.09008858 134.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe