CID 67272622

[3-(2-methylpropyl)pyridin-2-yl]methanol

Structural Information

Molecular Formula
C10H15NO
SMILES
CC(C)CC1=C(N=CC=C1)CO
InChI
InChI=1S/C10H15NO/c1-8(2)6-9-4-3-5-11-10(9)7-12/h3-5,8,12H,6-7H2,1-2H3
InChIKey
FKWWWWWOUBNXMM-UHFFFAOYSA-N
Compound name
[3-(2-methylpropyl)pyridin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

165.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 136.7
[M+Na]+ 188.10459 144.0
[M-H]- 164.10809 137.6
[M+NH4]+ 183.14919 155.6
[M+K]+ 204.07853 141.8
[M+H-H2O]+ 148.11263 130.5
[M+HCOO]- 210.11357 157.4
[M+CH3COO]- 224.12922 178.3
[M+Na-2H]- 186.09004 142.0
[M]+ 165.11482 136.8
[M]- 165.11592 136.8
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