CID 3001174

N'-pentanoylpyridine-4-carbohydrazide

Structural Information

Molecular Formula
C11H15N3O2
SMILES
CCCCC(=O)NNC(=O)C1=CC=NC=C1
InChI
InChI=1S/C11H15N3O2/c1-2-3-4-10(15)13-14-11(16)9-5-7-12-8-6-9/h5-8H,2-4H2,1H3,(H,13,15)(H,14,16)
InChIKey
VVQCYROSLKFIKX-UHFFFAOYSA-N
Compound name
N'-pentanoylpyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

221.11642 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12370 150.6
[M+Na]+ 244.10564 155.6
[M-H]- 220.10914 152.5
[M+NH4]+ 239.15024 166.8
[M+K]+ 260.07958 153.8
[M+H-H2O]+ 204.11368 142.7
[M+HCOO]- 266.11462 174.2
[M+CH3COO]- 280.13027 191.9
[M+Na-2H]- 242.09109 156.0
[M]+ 221.11587 150.2
[M]- 221.11697 150.2
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