CID 137293

4-ethenyl-n,n-dimethylaniline

Structural Information

Molecular Formula
C10H13N
SMILES
CN(C)C1=CC=C(C=C1)C=C
InChI
InChI=1S/C10H13N/c1-4-9-5-7-10(8-6-9)11(2)3/h4-8H,1H2,2-3H3
InChIKey
GQWAOUOHRMHSHL-UHFFFAOYSA-N
Compound name
4-ethenyl-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3956
Patents

147.1048 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.112076 130.3
[M+Na]+ 170.094018 137.9
[M-H]- 146.097524 135.6
[M+NH4]+ 165.138623 152.4
[M+K]+ 186.067958 136.6
[M+H-H2O]+ 130.102060 124.5
[M+HCOO]- 192.103001 156.4
[M+CH3COO]- 206.118651 183.0
[M+Na-2H]- 168.079466 137.0
[M]+ 147.10425142 130.9
[M]- 147.10534858 130.9
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