CID 71438761

(5-amino-6-methoxypyridin-3-yl)methanol

Structural Information

Molecular Formula
C7H10N2O2
SMILES
COC1=C(C=C(C=N1)CO)N
InChI
InChI=1S/C7H10N2O2/c1-11-7-6(8)2-5(4-10)3-9-7/h2-3,10H,4,8H2,1H3
InChIKey
SPVLIPFSKIVWOP-UHFFFAOYSA-N
Compound name
(5-amino-6-methoxy-3-pyridinyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.07423 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 130.2
[M+Na]+ 177.063448 139.0
[M-H]- 153.066954 131.3
[M+NH4]+ 172.108053 149.2
[M+K]+ 193.037388 137.2
[M+H-H2O]+ 137.071490 124.0
[M+HCOO]- 199.072431 153.5
[M+CH3COO]- 213.088081 175.8
[M+Na-2H]- 175.048896 136.8
[M]+ 154.07368142 129.9
[M]- 154.07477858 129.9
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.