CID 22978684

(6-tert-butylpyridin-3-yl)methanol

Structural Information

Molecular Formula
C10H15NO
SMILES
CC(C)(C)C1=NC=C(C=C1)CO
InChI
InChI=1S/C10H15NO/c1-10(2,3)9-5-4-8(7-12)6-11-9/h4-6,12H,7H2,1-3H3
InChIKey
RPUJAWBFTVIVNK-UHFFFAOYSA-N
Compound name
(6-tert-butylpyridin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

165.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 136.9
[M+Na]+ 188.10459 145.1
[M-H]- 164.10809 138.2
[M+NH4]+ 183.14919 156.2
[M+K]+ 204.07853 142.9
[M+H-H2O]+ 148.11263 131.4
[M+HCOO]- 210.11357 157.1
[M+CH3COO]- 224.12922 177.1
[M+Na-2H]- 186.09004 144.2
[M]+ 165.11482 137.2
[M]- 165.11592 137.2
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