CID 7061

N,n-diethylaniline

Structural Information

Molecular Formula
C10H15N
SMILES
CCN(CC)C1=CC=CC=C1
InChI
InChI=1S/C10H15N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
InChIKey
GGSUCNLOZRCGPQ-UHFFFAOYSA-N
Compound name
N,N-diethylaniline
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

48
References

55972
Patents

149.12045 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.12773 132.9
[M+Na]+ 172.10967 145.7
[M+NH4]+ 167.15427 142.8
[M+K]+ 188.08361 138.2
[M-H]- 148.11317 137.0
[M+Na-2H]- 170.09512 141.5
[M]+ 149.11990 135.9
[M]- 149.12100 135.9
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