CID 9578637

((2-methyl-3-benzofuranyl)methylene)hydrazide 1-pyrrolidineacetic acid hydrochloride

Structural Information

Molecular Formula
C16H19N3O2
SMILES
CC1=C(C2=CC=CC=C2O1)/C=N/NC(=O)CN3CCCC3
InChI
InChI=1S/C16H19N3O2/c1-12-14(13-6-2-3-7-15(13)21-12)10-17-18-16(20)11-19-8-4-5-9-19/h2-3,6-7,10H,4-5,8-9,11H2,1H3,(H,18,20)/b17-10+
InChIKey
OQZYFOOARLVSMA-LICLKQGHSA-N
Compound name
N-[(E)-(2-methyl-1-benzofuran-3-yl)methylideneamino]-2-pyrrolidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.14774 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.15502 166.7
[M+Na]+ 308.13696 176.8
[M+NH4]+ 303.18156 174.2
[M+K]+ 324.11090 174.2
[M-H]- 284.14046 171.7
[M+Na-2H]- 306.12241 171.7
[M]+ 285.14719 169.2
[M]- 285.14829 169.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.