CID 18488

Toluzide

Structural Information

Molecular Formula
C13H20N2O2
SMILES
CCC(CC)(C(=O)NNC1=CC=CC=C1C)O
InChI
InChI=1S/C13H20N2O2/c1-4-13(17,5-2)12(16)15-14-11-9-7-6-8-10(11)3/h6-9,14,17H,4-5H2,1-3H3,(H,15,16)
InChIKey
HDLUSZXJYBIFPI-UHFFFAOYSA-N
Compound name
2-ethyl-2-hydroxy-N'-(2-methylphenyl)butanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

236.15248 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.15976 155.9
[M+Na]+ 259.14170 160.8
[M-H]- 235.14520 158.0
[M+NH4]+ 254.18630 172.5
[M+K]+ 275.11564 158.4
[M+H-H2O]+ 219.14974 149.6
[M+HCOO]- 281.15068 177.8
[M+CH3COO]- 295.16633 195.6
[M+Na-2H]- 257.12715 160.9
[M]+ 236.15193 155.2
[M]- 236.15303 155.2
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

patents stripe