CID 9076

P-phenetidine

Structural Information

Molecular Formula
C8H11NO
SMILES
CCOC1=CC=C(C=C1)N
InChI
InChI=1S/C8H11NO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2,9H2,1H3
InChIKey
IMPPGHMHELILKG-UHFFFAOYSA-N
Compound name
4-ethoxyaniline
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

93
References

7621
Patents

137.08406 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.09134 126.7
[M+Na]+ 160.07328 139.3
[M+NH4]+ 155.11788 136.0
[M+K]+ 176.04722 132.8
[M-H]- 136.07678 129.9
[M+Na-2H]- 158.05873 134.4
[M]+ 137.08351 129.3
[M]- 137.08461 129.3
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