CID 42112

Brn 0453837

Structural Information

Molecular Formula
C19H22N4O3
SMILES
CCOC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3N2)OCCNN
InChI
InChI=1S/C19H22N4O3/c1-2-25-14-9-7-13(8-10-14)22-19(24)17-18(26-12-11-21-20)15-5-3-4-6-16(15)23-17/h3-10,21,23H,2,11-12,20H2,1H3,(H,22,24)
InChIKey
RFIWKXBBIVNPDW-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-3-(2-hydrazinylethoxy)-1H-indole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.1692 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.17648 179.5
[M+Na]+ 377.15842 185.3
[M-H]- 353.16192 184.5
[M+NH4]+ 372.20302 191.9
[M+K]+ 393.13236 180.5
[M+H-H2O]+ 337.16646 170.3
[M+HCOO]- 399.16740 203.6
[M+CH3COO]- 413.18305 218.6
[M+Na-2H]- 375.14387 183.9
[M]+ 354.16865 181.1
[M]- 354.16975 181.1
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

No patent data available for this compound.