CID 28414001

6-(cyclopropylmethoxy)pyridine-3-carbonitrile

Structural Information

Molecular Formula
C10H10N2O
SMILES
C1CC1COC2=NC=C(C=C2)C#N
InChI
InChI=1S/C10H10N2O/c11-5-9-3-4-10(12-6-9)13-7-8-1-2-8/h3-4,6,8H,1-2,7H2
InChIKey
ILPGCKPRZSRZTE-UHFFFAOYSA-N
Compound name
6-(cyclopropylmethoxy)pyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.07932 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.08660 134.7
[M+Na]+ 197.06854 150.3
[M-H]- 173.07204 141.6
[M+NH4]+ 192.11314 149.1
[M+K]+ 213.04248 143.8
[M+H-H2O]+ 157.07658 123.5
[M+HCOO]- 219.07752 156.5
[M+CH3COO]- 233.09317 195.0
[M+Na-2H]- 195.05399 143.2
[M]+ 174.07877 134.6
[M]- 174.07987 134.6
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.