CID 573206

2-methoxy-5-methylpyrimidin-4-amine

Structural Information

Molecular Formula
C6H9N3O
SMILES
CC1=CN=C(N=C1N)OC
InChI
InChI=1S/C6H9N3O/c1-4-3-8-6(10-2)9-5(4)7/h3H,1-2H3,(H2,7,8,9)
InChIKey
GAUNWPNZBQOHGF-UHFFFAOYSA-N
Compound name
2-methoxy-5-methylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

139.07455 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08183 126.4
[M+Na]+ 162.06377 139.2
[M+NH4]+ 157.10837 134.2
[M+K]+ 178.03771 133.9
[M-H]- 138.06727 127.9
[M+Na-2H]- 160.04922 133.4
[M]+ 139.07400 128.5
[M]- 139.07510 128.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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