CID 127574854

N-(3-hydroxypropyl)-4-methylpiperazine-1-carboxamide

Structural Information

Molecular Formula
C9H19N3O2
SMILES
CN1CCN(CC1)C(=O)NCCCO
InChI
InChI=1S/C9H19N3O2/c1-11-4-6-12(7-5-11)9(14)10-3-2-8-13/h13H,2-8H2,1H3,(H,10,14)
InChIKey
WNJNXVUPTXAHLC-UHFFFAOYSA-N
Compound name
N-(3-hydroxypropyl)-4-methylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.14772 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.15500 148.5
[M+Na]+ 224.13694 152.5
[M-H]- 200.14044 147.0
[M+NH4]+ 219.18154 163.9
[M+K]+ 240.11088 151.0
[M+H-H2O]+ 184.14498 140.8
[M+HCOO]- 246.14592 165.2
[M+CH3COO]- 260.16157 184.0
[M+Na-2H]- 222.12239 151.6
[M]+ 201.14717 144.2
[M]- 201.14827 144.2
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

No patent data available for this compound.