CID 25335775

4-(2-cyclopropyl-1,3-oxazol-5-yl)aniline

Structural Information

Molecular Formula
C12H12N2O
SMILES
C1CC1C2=NC=C(O2)C3=CC=C(C=C3)N
InChI
InChI=1S/C12H12N2O/c13-10-5-3-8(4-6-10)11-7-14-12(15-11)9-1-2-9/h3-7,9H,1-2,13H2
InChIKey
YUTWYOJPIUVEKL-UHFFFAOYSA-N
Compound name
4-(2-cyclopropyl-1,3-oxazol-5-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.09496 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.10224 145.7
[M+Na]+ 223.08418 160.6
[M+NH4]+ 218.12878 155.3
[M+K]+ 239.05812 157.1
[M-H]- 199.08768 159.2
[M+Na-2H]- 221.06963 156.8
[M]+ 200.09441 152.8
[M]- 200.09551 152.8
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.