CID 38697

40890-88-8

Structural Information

Molecular Formula
C13H19N3O2
SMILES
CN1CCN(CC1)CN(C(=O)C2=CC=CC=C2)O
InChI
InChI=1S/C13H19N3O2/c1-14-7-9-15(10-8-14)11-16(18)13(17)12-5-3-2-4-6-12/h2-6,18H,7-11H2,1H3
InChIKey
GANYELGAIAGDPB-UHFFFAOYSA-N
Compound name
N-hydroxy-N-[(4-methylpiperazin-1-yl)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.14772 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.15500 158.1
[M+Na]+ 272.13694 168.5
[M+NH4]+ 267.18154 164.9
[M+K]+ 288.11088 163.3
[M-H]- 248.14044 160.6
[M+Na-2H]- 270.12239 164.2
[M]+ 249.14717 159.9
[M]- 249.14827 159.9
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.