CID 53108

74764-93-5

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]+ 308.21211 176.0
[M+Na]+ 330.19405 183.5
[M-H]- 306.19755 185.4
[M+NH4]+ 325.23865 193.4
[M+K]+ 346.16799 179.9
[M+H-H2O]+ 290.20209 166.5
[M+HCOO]- 352.20303 202.0
[M+CH3COO]- 366.21868 219.7
[M+Na-2H]- 328.17950 179.5
[M]+ 307.20428 180.9
[M]- 307.20538 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