CID 173957

2-tert-butyl-6-methyl-3-hydroxypyridine

Structural Information

Molecular Formula
C10H15NO
SMILES
CC1=NC(=C(C=C1)O)C(C)(C)C
InChI
InChI=1S/C10H15NO/c1-7-5-6-8(12)9(11-7)10(2,3)4/h5-6,12H,1-4H3
InChIKey
GLANSBWYIOWFBX-UHFFFAOYSA-N
Compound name
2-tert-butyl-6-methylpyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
Patents

165.11537 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 136.3
[M+Na]+ 188.10459 145.3
[M-H]- 164.10809 138.0
[M+NH4]+ 183.14919 155.8
[M+K]+ 204.07853 143.2
[M+H-H2O]+ 148.11263 131.0
[M+HCOO]- 210.11357 156.4
[M+CH3COO]- 224.12922 178.3
[M+Na-2H]- 186.09004 142.8
[M]+ 165.11482 136.9
[M]- 165.11592 136.9
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.