CID 80778

Acetamide, n-[3-(diethylamino)phenyl]-

Structural Information

Molecular Formula
C12H18N2O
SMILES
CCN(CC)C1=CC=CC(=C1)NC(=O)C
InChI
InChI=1S/C12H18N2O/c1-4-14(5-2)12-8-6-7-11(9-12)13-10(3)15/h6-9H,4-5H2,1-3H3,(H,13,15)
InChIKey
FPUKYOSOAAPHTN-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

538
Patents

206.1419 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.14918 148.5
[M+Na]+ 229.13112 154.0
[M-H]- 205.13462 153.3
[M+NH4]+ 224.17572 167.6
[M+K]+ 245.10506 153.1
[M+H-H2O]+ 189.13916 141.5
[M+HCOO]- 251.14010 174.0
[M+CH3COO]- 265.15575 196.1
[M+Na-2H]- 227.11657 152.8
[M]+ 206.14135 149.6
[M]- 206.14245 149.6
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