CID 47002461

2-tert-butyl-5-hydrazinyl-1,3-oxazole-4-carbonitrile

Structural Information

Molecular Formula
C8H12N4O
SMILES
CC(C)(C)C1=NC(=C(O1)NN)C#N
InChI
InChI=1S/C8H12N4O/c1-8(2,3)7-11-5(4-9)6(12-10)13-7/h12H,10H2,1-3H3
InChIKey
LCJOUPGKBCXCJA-UHFFFAOYSA-N
Compound name
2-tert-butyl-5-hydrazinyl-1,3-oxazole-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.1011 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.10838 141.5
[M+Na]+ 203.09032 150.9
[M-H]- 179.09382 143.7
[M+NH4]+ 198.13492 158.1
[M+K]+ 219.06426 150.6
[M+H-H2O]+ 163.09836 128.2
[M+HCOO]- 225.09930 160.9
[M+CH3COO]- 239.11495 197.3
[M+Na-2H]- 201.07577 146.9
[M]+ 180.10055 136.4
[M]- 180.10165 136.4
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.