CID 6435181

Glycine, n-(alpha-methylphenethyl)-, 2-(2-benzofuranylmethylene)hydrazide, hydrochloride

Structural Information

Molecular Formula
C20H21N3O2
SMILES
CC(CN/C(=C/C1=CC2=CC=CC=C2O1)/C(=O)NN)C3=CC=CC=C3
InChI
InChI=1S/C20H21N3O2/c1-14(15-7-3-2-4-8-15)13-22-18(20(24)23-21)12-17-11-16-9-5-6-10-19(16)25-17/h2-12,14,22H,13,21H2,1H3,(H,23,24)/b18-12+
InChIKey
HCCDXHQWYCEVEM-LDADJPATSA-N
Compound name
(E)-3-(1-benzofuran-2-yl)-2-(2-phenylpropylamino)prop-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.1634 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.170676 181.3
[M+Na]+ 358.152618 185.5
[M-H]- 334.156124 188.8
[M+NH4]+ 353.197223 194.6
[M+K]+ 374.126558 181.9
[M+H-H2O]+ 318.160660 172.7
[M+HCOO]- 380.161601 204.8
[M+CH3COO]- 394.177251 216.9
[M+Na-2H]- 356.138066 184.5
[M]+ 335.16285142 180.8
[M]- 335.16394858 180.8
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.