CID 13825890

3-(cyclohexylmethoxy)pyridin-2-amine

Structural Information

Molecular Formula
C12H18N2O
SMILES
C1CCC(CC1)COC2=C(N=CC=C2)N
InChI
InChI=1S/C12H18N2O/c13-12-11(7-4-8-14-12)15-9-10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2,(H2,13,14)
InChIKey
GSQLAKVHHSYJHS-UHFFFAOYSA-N
Compound name
3-(cyclohexylmethoxy)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

106
Patents

206.1419 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.149176 146.9
[M+Na]+ 229.131118 151.4
[M-H]- 205.134624 150.8
[M+NH4]+ 224.175723 163.5
[M+K]+ 245.105058 148.5
[M+H-H2O]+ 189.139160 138.7
[M+HCOO]- 251.140101 167.0
[M+CH3COO]- 265.155751 187.0
[M+Na-2H]- 227.116566 151.8
[M]+ 206.14135142 141.6
[M]- 206.14244858 141.6
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

patents stripe