CID 43479

60789-89-1

Structural Information

Molecular Formula
C14H17N3O2
SMILES
CC1=CC(=NO1)C(=O)NNC(C)CC2=CC=CC=C2
InChI
InChI=1S/C14H17N3O2/c1-10(8-12-6-4-3-5-7-12)15-16-14(18)13-9-11(2)19-17-13/h3-7,9-10,15H,8H2,1-2H3,(H,16,18)
InChIKey
BYBUKOLWVLGTJF-UHFFFAOYSA-N
Compound name
5-methyl-N'-(1-phenylpropan-2-yl)-1,2-oxazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

259.13208 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.13936 161.3
[M+Na]+ 282.12130 171.5
[M+NH4]+ 277.16590 167.9
[M+K]+ 298.09524 168.2
[M-H]- 258.12480 165.7
[M+Na-2H]- 280.10675 167.4
[M]+ 259.13153 163.6
[M]- 259.13263 163.6
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

No patent data available for this compound.