CID 3060443

78123-16-7

Structural Information

Molecular Formula
C18H19N3O
SMILES
CC1=C(C2=CC=CC=C2N1)CC(=O)NNCC3=CC=CC=C3
InChI
InChI=1S/C18H19N3O/c1-13-16(15-9-5-6-10-17(15)20-13)11-18(22)21-19-12-14-7-3-2-4-8-14/h2-10,19-20H,11-12H2,1H3,(H,21,22)
InChIKey
OIFSAWMMKWNGHG-UHFFFAOYSA-N
Compound name
N'-benzyl-2-(2-methyl-1H-indol-3-yl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.1528 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.16008 167.2
[M+Na]+ 316.14202 174.0
[M-H]- 292.14552 172.5
[M+NH4]+ 311.18662 182.8
[M+K]+ 332.11596 167.9
[M+H-H2O]+ 276.15006 158.8
[M+HCOO]- 338.15100 191.0
[M+CH3COO]- 352.16665 178.2
[M+Na-2H]- 314.12747 172.8
[M]+ 293.15225 166.9
[M]- 293.15335 166.9
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

No patent data available for this compound.