CID 10590808

291756-76-8

Structural Information

Molecular Formula
C7H14ClN2
SMILES
CN(C)/C=C(/C=[N+](C)C)\Cl
InChI
InChI=1S/C7H14ClN2/c1-9(2)5-7(8)6-10(3)4/h5-6H,1-4H3/q+1
InChIKey
ZCWYTDUBAJRUHF-UHFFFAOYSA-N
Compound name
[(Z)-2-chloro-3-(dimethylamino)prop-2-enylidene]-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

190
Patents

161.08455 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.09183 134.4
[M+Na]+ 184.07377 141.1
[M-H]- 160.07727 137.7
[M+NH4]+ 179.11837 156.6
[M+K]+ 200.04771 135.1
[M+H-H2O]+ 144.08181 132.9
[M+HCOO]- 206.08275 155.6
[M+CH3COO]- 220.09840 181.4
[M+Na-2H]- 182.05922 140.4
[M]+ 161.08400 135.4
[M]- 161.08510 135.4
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