CID 3613942

N-methoxy-n-methyl-2-thiophenecarboxamide

Structural Information

Molecular Formula
C7H9NO2S
SMILES
CN(C(=O)C1=CC=CS1)OC
InChI
InChI=1S/C7H9NO2S/c1-8(10-2)7(9)6-4-3-5-11-6/h3-5H,1-2H3
InChIKey
DGMGILGPRYQSOX-UHFFFAOYSA-N
Compound name
N-methoxy-N-methylthiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

171.0354 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.04268 135.6
[M+Na]+ 194.02462 143.3
[M-H]- 170.02812 141.2
[M+NH4]+ 189.06922 158.6
[M+K]+ 209.99856 143.4
[M+H-H2O]+ 154.03266 129.7
[M+HCOO]- 216.03360 157.2
[M+CH3COO]- 230.04925 180.8
[M+Na-2H]- 192.01007 137.6
[M]+ 171.03485 139.7
[M]- 171.03595 139.7
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