CID 79585

N-ethylformanilide

Structural Information

Molecular Formula
C9H11NO
SMILES
CCN(C=O)C1=CC=CC=C1
InChI
InChI=1S/C9H11NO/c1-2-10(8-11)9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChIKey
GBDYFPAHVXJQEP-UHFFFAOYSA-N
Compound name
N-ethyl-N-phenylformamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1149
Patents

149.08406 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 129.8
[M+Na]+ 172.07328 136.8
[M-H]- 148.07678 134.8
[M+NH4]+ 167.11788 151.3
[M+K]+ 188.04722 136.2
[M+H-H2O]+ 132.08132 123.6
[M+HCOO]- 194.08226 156.4
[M+CH3COO]- 208.09791 180.8
[M+Na-2H]- 170.05873 137.6
[M]+ 149.08351 131.0
[M]- 149.08461 131.0
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