CID 11364

N-methylacetanilide

Structural Information

Molecular Formula
C9H11NO
SMILES
CC(=O)N(C)C1=CC=CC=C1
InChI
InChI=1S/C9H11NO/c1-8(11)10(2)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey
LMTGCJANOQOGPI-UHFFFAOYSA-N
Compound name
N-methyl-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

2106
Patents

149.08406 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 131.1
[M+Na]+ 172.07328 143.3
[M+NH4]+ 167.11788 140.2
[M+K]+ 188.04722 137.3
[M-H]- 148.07678 134.2
[M+Na-2H]- 170.05873 139.0
[M]+ 149.08351 133.7
[M]- 149.08461 133.7
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