CID 3079177

Alpha-((bis(2-methylpropyl)amino)methyl)-4-chloro-gamma-hydroxybenzenebutanoic acid hydrazide

Structural Information

Molecular Formula
C19H32ClN3O2
SMILES
CC(C)CN(CC(C)C)CC(CC(C1=CC=C(C=C1)Cl)O)C(=O)NN
InChI
InChI=1S/C19H32ClN3O2/c1-13(2)10-23(11-14(3)4)12-16(19(25)22-21)9-18(24)15-5-7-17(20)8-6-15/h5-8,13-14,16,18,24H,9-12,21H2,1-4H3,(H,22,25)
InChIKey
ZFURMIQXQIBYKD-UHFFFAOYSA-N
Compound name
2-[[bis(2-methylpropyl)amino]methyl]-4-(4-chlorophenyl)-4-hydroxybutanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.2183 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.22558 193.3
[M+Na]+ 392.20752 199.2
[M+NH4]+ 387.25212 198.1
[M+K]+ 408.18146 195.3
[M-H]- 368.21102 194.2
[M+Na-2H]- 390.19297 194.5
[M]+ 369.21775 194.1
[M]- 369.21885 194.1
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.