CID 6481762

3-isoxazolamine, 5-(2,4-dimethoxyphenyl)-n,n-diethyl-

Structural Information

Molecular Formula
C15H20N2O3
SMILES
CCN(CC)C1=NOC(=C1)C2=C(C=C(C=C2)OC)OC
InChI
InChI=1S/C15H20N2O3/c1-5-17(6-2)15-10-14(20-16-15)12-8-7-11(18-3)9-13(12)19-4/h7-10H,5-6H2,1-4H3
InChIKey
FHQGZKKFEYXYCH-UHFFFAOYSA-N
Compound name
5-(2,4-dimethoxyphenyl)-N,N-diethyl-1,2-oxazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.1474 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.15468 164.2
[M+Na]+ 299.13662 172.2
[M-H]- 275.14012 172.2
[M+NH4]+ 294.18122 180.2
[M+K]+ 315.11056 172.0
[M+H-H2O]+ 259.14466 155.9
[M+HCOO]- 321.14560 189.0
[M+CH3COO]- 335.16125 205.4
[M+Na-2H]- 297.12207 167.6
[M]+ 276.14685 171.6
[M]- 276.14795 171.6
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.