CID 21854223

Dipropyl-4-hydroxytryptamine

Structural Information

Molecular Formula
C16H24N2O
SMILES
CCCN(CCC)CCC1=CNC2=C1C(=CC=C2)O
InChI
InChI=1S/C16H24N2O/c1-3-9-18(10-4-2)11-8-13-12-17-14-6-5-7-15(19)16(13)14/h5-7,12,17,19H,3-4,8-11H2,1-2H3
InChIKey
MZLRMPTVOVJXLW-UHFFFAOYSA-N
Compound name
3-[2-(dipropylamino)ethyl]-1H-indol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

260
Patents

260.18887 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.196146 163.5
[M+Na]+ 283.178088 170.5
[M-H]- 259.181594 165.3
[M+NH4]+ 278.222693 181.3
[M+K]+ 299.152028 166.0
[M+H-H2O]+ 243.186130 156.3
[M+HCOO]- 305.187071 185.3
[M+CH3COO]- 319.202721 199.5
[M+Na-2H]- 281.163536 166.9
[M]+ 260.18832142 166.4
[M]- 260.18941858 166.4
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