CID 6435175

N-(alpha-methylphenethyl)glycine 2-(2,3,5,6-tetramethylbenzylidene)hydrazide

Structural Information

Molecular Formula
C22H29N3O
SMILES
CC1=CC(=C(C(=C1C)/C=C(\C(=O)NN)/NCC(C)C2=CC=CC=C2)C)C
InChI
InChI=1S/C22H29N3O/c1-14-11-15(2)18(5)20(17(14)4)12-21(22(26)25-23)24-13-16(3)19-9-7-6-8-10-19/h6-12,16,24H,13,23H2,1-5H3,(H,25,26)/b21-12+
InChIKey
GEDOGZQJMFMXOT-CIAFOILYSA-N
Compound name
(E)-2-(2-phenylpropylamino)-3-(2,3,5,6-tetramethylphenyl)prop-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.23105 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.23833 191.1
[M+Na]+ 374.22027 195.1
[M-H]- 350.22377 197.1
[M+NH4]+ 369.26487 203.3
[M+K]+ 390.19421 190.4
[M+H-H2O]+ 334.22831 182.3
[M+HCOO]- 396.22925 212.7
[M+CH3COO]- 410.24490 227.2
[M+Na-2H]- 372.20572 188.4
[M]+ 351.23050 189.5
[M]- 351.23160 189.5
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.