CID 53108

Indole, 1-((2-(dimethylamino)ethyl)methylamino)-5-methyl-3-phenyl-, hydrochloride

Structural Information

Molecular Formula
C20H25N3
SMILES
CC1=CC2=C(C=C1)N(C=C2C3=CC=CC=C3)N(C)CCN(C)C
InChI
InChI=1S/C20H25N3/c1-16-10-11-20-18(14-16)19(17-8-6-5-7-9-17)15-23(20)22(4)13-12-21(2)3/h5-11,14-15H,12-13H2,1-4H3
InChIKey
WTKLXVFTECURNQ-UHFFFAOYSA-N
Compound name
N,N,N'-trimethyl-N'-(5-methyl-3-phenylindol-1-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

307.20483 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.212106 176.0
[M+Na]+ 330.194048 183.5
[M-H]- 306.197554 185.4
[M+NH4]+ 325.238653 193.4
[M+K]+ 346.167988 179.9
[M+H-H2O]+ 290.202090 166.5
[M+HCOO]- 352.203031 202.0
[M+CH3COO]- 366.218681 219.7
[M+Na-2H]- 328.179496 179.5
[M]+ 307.20428142 180.9
[M]- 307.20537858 180.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe