CID 2755701

N-(6-methoxypyridin-3-yl)acetamide

Structural Information

Molecular Formula
C8H10N2O2
SMILES
CC(=O)NC1=CN=C(C=C1)OC
InChI
InChI=1S/C8H10N2O2/c1-6(11)10-7-3-4-8(12-2)9-5-7/h3-5H,1-2H3,(H,10,11)
InChIKey
FAQHEHIKPSXQSN-UHFFFAOYSA-N
Compound name
N-(6-methoxy-3-pyridinyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

55
Patents

166.07423 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.081506 133.1
[M+Na]+ 189.063448 141.1
[M-H]- 165.066954 135.8
[M+NH4]+ 184.108053 152.2
[M+K]+ 205.037388 140.2
[M+H-H2O]+ 149.071490 126.4
[M+HCOO]- 211.072431 157.5
[M+CH3COO]- 225.088081 180.2
[M+Na-2H]- 187.048896 140.3
[M]+ 166.07368142 134.3
[M]- 166.07477858 134.3
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