CID 90062240

2,6-dichloro-3-ethenylpyridine

Structural Information

Molecular Formula
C7H5Cl2N
SMILES
C=CC1=C(N=C(C=C1)Cl)Cl
InChI
InChI=1S/C7H5Cl2N/c1-2-5-3-4-6(8)10-7(5)9/h2-4H,1H2
InChIKey
BUQNJBNZWHYJDU-UHFFFAOYSA-N
Compound name
2,6-dichloro-3-ethenylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

172.9799 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.98718 128.6
[M+Na]+ 195.96912 140.0
[M-H]- 171.97262 130.5
[M+NH4]+ 191.01372 149.2
[M+K]+ 211.94306 134.6
[M+H-H2O]+ 155.97716 124.2
[M+HCOO]- 217.97810 142.8
[M+CH3COO]- 231.99375 178.1
[M+Na-2H]- 193.95457 135.3
[M]+ 172.97935 131.0
[M]- 172.98045 131.0
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