CID 2474265

851721-91-0

Structural Information

Molecular Formula
C14H15NO4
SMILES
CC1=C(C(=NO1)C)COC2=C(C=C(C=C2)C=O)OC
InChI
InChI=1S/C14H15NO4/c1-9-12(10(2)19-15-9)8-18-13-5-4-11(7-16)6-14(13)17-3/h4-7H,8H2,1-3H3
InChIKey
KRSBKCIZARFCOA-UHFFFAOYSA-N
Compound name
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxybenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

261.1001 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.10738 156.2
[M+Na]+ 284.08932 166.5
[M-H]- 260.09282 163.3
[M+NH4]+ 279.13392 172.7
[M+K]+ 300.06326 165.3
[M+H-H2O]+ 244.09736 148.9
[M+HCOO]- 306.09830 180.2
[M+CH3COO]- 320.11395 196.6
[M+Na-2H]- 282.07477 159.8
[M]+ 261.09955 163.8
[M]- 261.10065 163.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.