CID 601234

43141-69-1

Structural Information

Molecular Formula
C14H23NO
SMILES
CCCCN(CCCC)C1=CC(=CC=C1)O
InChI
InChI=1S/C14H23NO/c1-3-5-10-15(11-6-4-2)13-8-7-9-14(16)12-13/h7-9,12,16H,3-6,10-11H2,1-2H3
InChIKey
KHSTZMGCKHBFJX-UHFFFAOYSA-N
Compound name
3-(dibutylamino)phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

282
Patents

221.17796 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.185236 154.6
[M+Na]+ 244.167178 159.7
[M-H]- 220.170684 157.6
[M+NH4]+ 239.211783 172.9
[M+K]+ 260.141118 157.5
[M+H-H2O]+ 204.175220 147.8
[M+HCOO]- 266.176161 177.8
[M+CH3COO]- 280.191811 195.3
[M+Na-2H]- 242.152626 158.4
[M]+ 221.17741142 156.8
[M]- 221.17850858 156.8
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

patents stripe