CID 57125

96730-43-7

Structural Information

Molecular Formula
C13H15N3O3
SMILES
CC1=CC(=NO1)C(=O)NNCC2=CC=C(C=C2)OC
InChI
InChI=1S/C13H15N3O3/c1-9-7-12(16-19-9)13(17)15-14-8-10-3-5-11(18-2)6-4-10/h3-7,14H,8H2,1-2H3,(H,15,17)
InChIKey
VWNBWAMNROSAHL-UHFFFAOYSA-N
Compound name
N'-[(4-methoxyphenyl)methyl]-5-methyl-1,2-oxazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.11133 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.11861 158.3
[M+Na]+ 284.10055 165.2
[M-H]- 260.10405 164.9
[M+NH4]+ 279.14515 173.5
[M+K]+ 300.07449 164.0
[M+H-H2O]+ 244.10859 149.9
[M+HCOO]- 306.10953 183.5
[M+CH3COO]- 320.12518 199.4
[M+Na-2H]- 282.08600 163.5
[M]+ 261.11078 161.1
[M]- 261.11188 161.1
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

No patent data available for this compound.