CID 580061

(5-methylpyrazin-2-yl)methanol

Structural Information

Molecular Formula
C6H8N2O
SMILES
CC1=CN=C(C=N1)CO
InChI
InChI=1S/C6H8N2O/c1-5-2-8-6(4-9)3-7-5/h2-3,9H,4H2,1H3
InChIKey
QYANNJBVADZUDN-UHFFFAOYSA-N
Compound name
(5-methylpyrazin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

192
Patents

124.06366 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 123.1
[M+Na]+ 147.05288 136.6
[M+NH4]+ 142.09748 131.2
[M+K]+ 163.02682 130.7
[M-H]- 123.05638 123.9
[M+Na-2H]- 145.03833 130.5
[M]+ 124.06311 125.2
[M]- 124.06421 125.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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