CID 605391

4-(dibutylamino)benzaldehyde

Structural Information

Molecular Formula
C15H23NO
SMILES
CCCCN(CCCC)C1=CC=C(C=C1)C=O
InChI
InChI=1S/C15H23NO/c1-3-5-11-16(12-6-4-2)15-9-7-14(13-17)8-10-15/h7-10,13H,3-6,11-12H2,1-2H3
InChIKey
VNWPLOWYHIDMEB-UHFFFAOYSA-N
Compound name
4-(dibutylamino)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

850
Patents

233.17796 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.18524 157.5
[M+Na]+ 256.16718 169.1
[M+NH4]+ 251.21178 165.6
[M+K]+ 272.14112 161.1
[M-H]- 232.17068 160.5
[M+Na-2H]- 254.15263 163.8
[M]+ 233.17741 159.9
[M]- 233.17851 159.9
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

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