CID 2763610

1-methyl-1h-pyrrole-2-carbohydrazide

Structural Information

Molecular Formula
C6H9N3O
SMILES
CN1C=CC=C1C(=O)NN
InChI
InChI=1S/C6H9N3O/c1-9-4-2-3-5(9)6(10)8-7/h2-4H,7H2,1H3,(H,8,10)
InChIKey
JPZLSTHDNAMYND-UHFFFAOYSA-N
Compound name
1-methylpyrrole-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

49
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 127.1
[M+Na]+ 162.06377 134.9
[M-H]- 138.06727 129.5
[M+NH4]+ 157.10837 148.5
[M+K]+ 178.03771 133.8
[M+H-H2O]+ 122.07181 120.6
[M+HCOO]- 184.07275 152.9
[M+CH3COO]- 198.08840 176.5
[M+Na-2H]- 160.04922 132.3
[M]+ 139.07400 124.9
[M]- 139.07510 124.9
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

patents stripe