CID 33632

Aniline, 3,4-methylenedioxy-n-(2-oxazolinyl)-

Structural Information

Molecular Formula
C10H10N2O3
SMILES
C1COC(=N1)NC2=CC3=C(C=C2)OCO3
InChI
InChI=1S/C10H10N2O3/c1-2-8-9(15-6-14-8)5-7(1)12-10-11-3-4-13-10/h1-2,5H,3-4,6H2,(H,11,12)
InChIKey
SMPAXXXLWWFLFY-UHFFFAOYSA-N
Compound name
N-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06914 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.07642 141.4
[M+Na]+ 229.05836 153.0
[M+NH4]+ 224.10296 149.9
[M+K]+ 245.03230 152.2
[M-H]- 205.06186 148.5
[M+Na-2H]- 227.04381 146.2
[M]+ 206.06859 145.0
[M]- 206.06969 145.0
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.