CID 107146

2-(1-naphthyl)-4-pentenoic acid isopropylhydrazide

Structural Information

Molecular Formula
C18H22N2O
SMILES
CC(C)NNC(=O)C(CC=C)C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C18H22N2O/c1-4-8-17(18(21)20-19-13(2)3)16-12-7-10-14-9-5-6-11-15(14)16/h4-7,9-13,17,19H,1,8H2,2-3H3,(H,20,21)
InChIKey
NUJZVNHAGUEUAQ-UHFFFAOYSA-N
Compound name
2-naphthalen-1-yl-N'-propan-2-ylpent-4-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.17322 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.18050 169.0
[M+Na]+ 305.16244 172.8
[M-H]- 281.16594 172.5
[M+NH4]+ 300.20704 184.9
[M+K]+ 321.13638 168.9
[M+H-H2O]+ 265.17048 161.4
[M+HCOO]- 327.17142 190.0
[M+CH3COO]- 341.18707 209.2
[M+Na-2H]- 303.14789 172.0
[M]+ 282.17267 167.8
[M]- 282.17377 167.8
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.