CID 82074673

2-(5-cyclopropyl-1,2-oxazol-3-yl)ethan-1-amine

Structural Information

Molecular Formula
C8H12N2O
SMILES
C1CC1C2=CC(=NO2)CCN
InChI
InChI=1S/C8H12N2O/c9-4-3-7-5-8(11-10-7)6-1-2-6/h5-6H,1-4,9H2
InChIKey
SEMXFXJICAHPHX-UHFFFAOYSA-N
Compound name
2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine
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 132.9
[M+Na]+ 175.08418 145.2
[M+NH4]+ 170.12878 141.8
[M+K]+ 191.05812 143.0
[M-H]- 151.08768 143.6
[M+Na-2H]- 173.06963 141.3
[M]+ 152.09441 138.6
[M]- 152.09551 138.6
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.