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]+ 175.086596 134.7
[M+Na]+ 197.068538 150.3
[M-H]- 173.072044 141.6
[M+NH4]+ 192.113143 149.1
[M+K]+ 213.042478 143.8
[M+H-H2O]+ 157.076580 123.5
[M+HCOO]- 219.077521 156.5
[M+CH3COO]- 233.093171 195.0
[M+Na-2H]- 195.053986 143.2
[M]+ 174.07877142 134.6
[M]- 174.07986858 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.