CID 2741969

Akos005275916

Structural Information

Molecular Formula
C20H23ClN2O2
SMILES
CC(C)CC1=CC=C(C=C1)C(C)C(=O)NNC(=O)C2=CC=CC=C2Cl
InChI
InChI=1S/C20H23ClN2O2/c1-13(2)12-15-8-10-16(11-9-15)14(3)19(24)22-23-20(25)17-6-4-5-7-18(17)21/h4-11,13-14H,12H2,1-3H3,(H,22,24)(H,23,25)
InChIKey
GISDHSUPCDKXTR-UHFFFAOYSA-N
Compound name
2-chloro-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

358.1448 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.152076 187.2
[M+Na]+ 381.134018 191.7
[M-H]- 357.137524 193.4
[M+NH4]+ 376.178623 200.0
[M+K]+ 397.107958 186.8
[M+H-H2O]+ 341.142060 179.6
[M+HCOO]- 403.143001 204.0
[M+CH3COO]- 417.158651 219.9
[M+Na-2H]- 379.119466 186.1
[M]+ 358.14425142 189.0
[M]- 358.14534858 189.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.