CID 89451

21165-52-6

Structural Information

Molecular Formula
C17H17Cl2N
SMILES
CN(C)CC=C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C17H17Cl2N/c1-20(2)12-11-17(13-3-7-15(18)8-4-13)14-5-9-16(19)10-6-14/h3-11H,12H2,1-2H3
InChIKey
SRNRETSVFRMCNT-UHFFFAOYSA-N
Compound name
3,3-bis(4-chlorophenyl)-N,N-dimethylprop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

305.0738 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.08108 169.8
[M+Na]+ 328.06302 177.7
[M-H]- 304.06652 176.7
[M+NH4]+ 323.10762 186.5
[M+K]+ 344.03696 170.9
[M+H-H2O]+ 288.07106 163.3
[M+HCOO]- 350.07200 184.2
[M+CH3COO]- 364.08765 208.9
[M+Na-2H]- 326.04847 171.8
[M]+ 305.07325 173.5
[M]- 305.07435 173.5
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

patents stripe