CID 6435168

Glycine, n-(alpha-methylphenethyl)-, 2-(2,4,6-trimethylbenzylidene)hydrazide

Structural Information

Molecular Formula
C21H27N3O
SMILES
CC1=CC(=C(C(=C1)C)/C=C(\C(=O)NN)/NC(C)CC2=CC=CC=C2)C
InChI
InChI=1S/C21H27N3O/c1-14-10-15(2)19(16(3)11-14)13-20(21(25)24-22)23-17(4)12-18-8-6-5-7-9-18/h5-11,13,17,23H,12,22H2,1-4H3,(H,24,25)/b20-13+
InChIKey
NWARJTCHCBALRN-DEDYPNTBSA-N
Compound name
(E)-2-(1-phenylpropan-2-ylamino)-3-(2,4,6-trimethylphenyl)prop-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.21542 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.222696 186.5
[M+Na]+ 360.204638 190.0
[M-H]- 336.208144 192.2
[M+NH4]+ 355.249243 198.9
[M+K]+ 376.178578 185.4
[M+H-H2O]+ 320.212680 177.6
[M+HCOO]- 382.213621 208.4
[M+CH3COO]- 396.229271 222.9
[M+Na-2H]- 358.190086 185.0
[M]+ 337.21487142 184.1
[M]- 337.21596858 184.1
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.