CID 65180086

2126178-31-0

Structural Information

Molecular Formula
C6H9N3O
SMILES
CN1C=C(C=N1)C(=O)CN
InChI
InChI=1S/C6H9N3O/c1-9-4-5(3-8-9)6(10)2-7/h3-4H,2,7H2,1H3
InChIKey
GTODUQSLRPFYJX-UHFFFAOYSA-N
Compound name
2-amino-1-(1-methylpyrazol-4-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

139.07455 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08183 127.9
[M+Na]+ 162.06377 137.9
[M+NH4]+ 157.10837 135.0
[M+K]+ 178.03771 135.5
[M-H]- 138.06727 127.8
[M+Na-2H]- 160.04922 132.7
[M]+ 139.07400 128.9
[M]- 139.07510 128.9
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

patents stripe