CID 13319495

4-(cyclohex-1-en-1-yl)pyridine hydrochloride

Structural Information

Molecular Formula
C11H13N
SMILES
C1CCC(=CC1)C2=CC=NC=C2
InChI
InChI=1S/C11H13N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h4,6-9H,1-3,5H2
InChIKey
YSDKUDZYCZEFEZ-UHFFFAOYSA-N
Compound name
4-(cyclohexen-1-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

159.1048 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.112076 133.3
[M+Na]+ 182.094018 139.2
[M-H]- 158.097524 137.9
[M+NH4]+ 177.138623 152.3
[M+K]+ 198.067958 136.3
[M+H-H2O]+ 142.102060 125.7
[M+HCOO]- 204.103001 154.5
[M+CH3COO]- 218.118651 146.1
[M+Na-2H]- 180.079466 141.2
[M]+ 159.10425142 128.9
[M]- 159.10534858 128.9
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