CID 156587209

2-cyclopropyl-3-ethynylpyridine

Structural Information

Molecular Formula
C10H9N
SMILES
C#CC1=C(N=CC=C1)C2CC2
InChI
InChI=1S/C10H9N/c1-2-8-4-3-7-11-10(8)9-5-6-9/h1,3-4,7,9H,5-6H2
InChIKey
ALWCUBNSYLKVON-UHFFFAOYSA-N
Compound name
2-cyclopropyl-3-ethynylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.0735 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.080776 127.6
[M+Na]+ 166.062718 143.9
[M-H]- 142.066224 133.6
[M+NH4]+ 161.107323 143.0
[M+K]+ 182.036658 136.4
[M+H-H2O]+ 126.070760 117.2
[M+HCOO]- 188.071701 147.3
[M+CH3COO]- 202.087351 141.4
[M+Na-2H]- 164.048166 135.7
[M]+ 143.07295142 125.4
[M]- 143.07404858 125.4
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

No patent data available for this compound.