CID 21854225

132328-45-1

Structural Information

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

2D Structure

compound 2d structure
2
Annotation Hits

1
References

280
Patents

260.18887 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.19615 164.6
[M+Na]+ 283.17809 170.9
[M-H]- 259.18159 166.6
[M+NH4]+ 278.22269 182.2
[M+K]+ 299.15203 167.5
[M+H-H2O]+ 243.18613 157.7
[M+HCOO]- 305.18707 184.3
[M+CH3COO]- 319.20272 201.4
[M+Na-2H]- 281.16354 165.5
[M]+ 260.18832 166.2
[M]- 260.18942 166.2
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