CID 16904

Isonicotinic acid, 2-ethylhydrazide

Structural Information

Molecular Formula
C8H11N3O
SMILES
CCNNC(=O)C1=CC=NC=C1
InChI
InChI=1S/C8H11N3O/c1-2-10-11-8(12)7-3-5-9-6-4-7/h3-6,10H,2H2,1H3,(H,11,12)
InChIKey
QUTHVQGMPKXJQP-UHFFFAOYSA-N
Compound name
N'-ethylpyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

7
Patents

165.09021 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.097486 134.1
[M+Na]+ 188.079428 140.3
[M-H]- 164.082934 136.3
[M+NH4]+ 183.124033 152.6
[M+K]+ 204.053368 138.8
[M+H-H2O]+ 148.087470 126.8
[M+HCOO]- 210.088411 159.2
[M+CH3COO]- 224.104061 182.0
[M+Na-2H]- 186.064876 142.4
[M]+ 165.08966142 132.7
[M]- 165.09075858 132.7
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