CID 468614

Schembl3001440

Structural Information

Molecular Formula
C10H15N3O
SMILES
CCC(C)NNC(=O)C1=CC=NC=C1
InChI
InChI=1S/C10H15N3O/c1-3-8(2)12-13-10(14)9-4-6-11-7-5-9/h4-8,12H,3H2,1-2H3,(H,13,14)
InChIKey
DHZMQULBYYDRIB-UHFFFAOYSA-N
Compound name
N'-butan-2-ylpyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

193.1215 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.12878 144.0
[M+Na]+ 216.11072 149.0
[M-H]- 192.11422 145.9
[M+NH4]+ 211.15532 161.2
[M+K]+ 232.08466 147.5
[M+H-H2O]+ 176.11876 136.4
[M+HCOO]- 238.11970 167.4
[M+CH3COO]- 252.13535 188.9
[M+Na-2H]- 214.09617 149.9
[M]+ 193.12095 142.6
[M]- 193.12205 142.6
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