CID 6435168

Brn 2165977

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]+ 338.22270 186.5
[M+Na]+ 360.20464 190.0
[M-H]- 336.20814 192.2
[M+NH4]+ 355.24924 198.9
[M+K]+ 376.17858 185.4
[M+H-H2O]+ 320.21268 177.6
[M+HCOO]- 382.21362 208.4
[M+CH3COO]- 396.22927 222.9
[M+Na-2H]- 358.19009 185.0
[M]+ 337.21487 184.1
[M]- 337.21597 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.