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]+ 153.10224 126.7
[M+Na]+ 175.08418 132.5
[M-H]- 151.08768 132.2
[M+NH4]+ 170.12878 139.9
[M+K]+ 191.05812 135.1
[M+H-H2O]+ 135.09222 115.0
[M+HCOO]- 197.09316 148.9
[M+CH3COO]- 211.10881 179.8
[M+Na-2H]- 173.06963 132.3
[M]+ 152.09441 133.9
[M]- 152.09551 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.