CID 27270

O-chlorophenylhydrazide of diethylglycolic acid

Structural Information

Molecular Formula
C12H17ClN2O2
SMILES
CCC(CC)(C(=O)NNC1=CC=CC=C1Cl)O
InChI
InChI=1S/C12H17ClN2O2/c1-3-12(17,4-2)11(16)15-14-10-8-6-5-7-9(10)13/h5-8,14,17H,3-4H2,1-2H3,(H,15,16)
InChIKey
MJNUHXWHAICZIF-UHFFFAOYSA-N
Compound name
N'-(2-chlorophenyl)-2-ethyl-2-hydroxybutanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.09787 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.10515 158.1
[M+Na]+ 279.08709 164.2
[M-H]- 255.09059 160.2
[M+NH4]+ 274.13169 174.8
[M+K]+ 295.06103 160.0
[M+H-H2O]+ 239.09513 152.9
[M+HCOO]- 301.09607 175.8
[M+CH3COO]- 315.11172 196.4
[M+Na-2H]- 277.07254 163.1
[M]+ 256.09732 159.1
[M]- 256.09842 159.1
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.