CID 58714

Brn 0780041

Structural Information

Molecular Formula
C9H15N3O2
SMILES
CCCCNNC(=O)C1=NOC(=C1)C
InChI
InChI=1S/C9H15N3O2/c1-3-4-5-10-11-9(13)8-6-7(2)14-12-8/h6,10H,3-5H2,1-2H3,(H,11,13)
InChIKey
XUZKNMCMPDHWIY-UHFFFAOYSA-N
Compound name
N'-butyl-5-methyl-1,2-oxazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

197.11642 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.123696 144.7
[M+Na]+ 220.105638 151.1
[M-H]- 196.109144 147.6
[M+NH4]+ 215.150243 162.6
[M+K]+ 236.079578 151.0
[M+H-H2O]+ 180.113680 137.4
[M+HCOO]- 242.114621 169.4
[M+CH3COO]- 256.130271 188.3
[M+Na-2H]- 218.091086 150.1
[M]+ 197.11587142 146.6
[M]- 197.11696858 146.6
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