CID 3015378

P-diethylaminoethylstyrene

Structural Information

Molecular Formula
C14H21N
SMILES
CCN(CC)CCC1=CC=C(C=C1)C=C
InChI
InChI=1S/C14H21N/c1-4-13-7-9-14(10-8-13)11-12-15(5-2)6-3/h4,7-10H,1,5-6,11-12H2,2-3H3
InChIKey
BIOCRZSYHQYVSG-UHFFFAOYSA-N
Compound name
2-(4-ethenylphenyl)-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2872
Patents

203.1674 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.174676 149.2
[M+Na]+ 226.156618 155.1
[M-H]- 202.160124 153.7
[M+NH4]+ 221.201223 169.0
[M+K]+ 242.130558 152.7
[M+H-H2O]+ 186.164660 142.5
[M+HCOO]- 248.165601 173.9
[M+CH3COO]- 262.181251 195.1
[M+Na-2H]- 224.142066 153.6
[M]+ 203.16685142 151.2
[M]- 203.16794858 151.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.