CID 28605427

861673-68-9

Structural Information

Molecular Formula
C15H18N2O
SMILES
CC(C)(C)C1=CC=CC=C1OC2=C(C=CC=N2)N
InChI
InChI=1S/C15H18N2O/c1-15(2,3)11-7-4-5-9-13(11)18-14-12(16)8-6-10-17-14/h4-10H,16H2,1-3H3
InChIKey
WPGHJCCTOPOERH-UHFFFAOYSA-N
Compound name
2-(2-tert-butylphenoxy)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

242.1419 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.149176 157.4
[M+Na]+ 265.131118 165.1
[M-H]- 241.134624 162.7
[M+NH4]+ 260.175723 173.3
[M+K]+ 281.105058 161.4
[M+H-H2O]+ 225.139160 149.5
[M+HCOO]- 287.140101 179.2
[M+CH3COO]- 301.155751 195.9
[M+Na-2H]- 263.116566 163.6
[M]+ 242.14135142 157.3
[M]- 242.14244858 157.3
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