CID 36291

Benzoxazole, 2-(o-(2-diethylaminoethoxy)phenyl)-

Structural Information

Molecular Formula
C19H22N2O2
SMILES
CCN(CC)CCOC1=CC=CC=C1C2=NC3=CC=CC=C3O2
InChI
InChI=1S/C19H22N2O2/c1-3-21(4-2)13-14-22-17-11-7-5-9-15(17)19-20-16-10-6-8-12-18(16)23-19/h5-12H,3-4,13-14H2,1-2H3
InChIKey
XTBXCUINWTYKRX-UHFFFAOYSA-N
Compound name
2-[2-(1,3-benzoxazol-2-yl)phenoxy]-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.16812 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.175396 174.5
[M+Na]+ 333.157338 182.3
[M-H]- 309.160844 182.9
[M+NH4]+ 328.201943 189.7
[M+K]+ 349.131278 179.7
[M+H-H2O]+ 293.165380 165.3
[M+HCOO]- 355.166321 198.8
[M+CH3COO]- 369.181971 211.4
[M+Na-2H]- 331.142786 180.0
[M]+ 310.16757142 181.4
[M]- 310.16866858 181.4
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.