CID 3719902

4-(2-morpholinoethoxy)benzaldehyde

Structural Information

Molecular Formula
C13H17NO3
SMILES
C1COCCN1CCOC2=CC=C(C=C2)C=O
InChI
InChI=1S/C13H17NO3/c15-11-12-1-3-13(4-2-12)17-10-7-14-5-8-16-9-6-14/h1-4,11H,5-10H2
InChIKey
FGLXMUOMJOHGKH-UHFFFAOYSA-N
Compound name
4-(2-morpholin-4-ylethoxy)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

296
Patents

235.12085 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.12813 153.7
[M+Na]+ 258.11007 166.2
[M+NH4]+ 253.15467 161.4
[M+K]+ 274.08401 159.5
[M-H]- 234.11357 158.0
[M+Na-2H]- 256.09552 160.3
[M]+ 235.12030 156.6
[M]- 235.12140 156.6
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

patents stripe