CID 83671450

1501681-14-6

Structural Information

Molecular Formula
C8H12N2O
SMILES
C1CC(C1)C2=NOC=C2CN
InChI
InChI=1S/C8H12N2O/c9-4-7-5-11-10-8(7)6-2-1-3-6/h5-6H,1-4,9H2
InChIKey
ROBNALPUKJVGAG-UHFFFAOYSA-N
Compound name
(3-cyclobutyl-1,2-oxazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.09496 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.102236 126.7
[M+Na]+ 175.084178 132.5
[M-H]- 151.087684 132.2
[M+NH4]+ 170.128783 139.9
[M+K]+ 191.058118 135.1
[M+H-H2O]+ 135.092220 115.0
[M+HCOO]- 197.093161 148.9
[M+CH3COO]- 211.108811 179.8
[M+Na-2H]- 173.069626 132.3
[M]+ 152.09441142 133.9
[M]- 152.09550858 133.9
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.