CID 129853

Dtxsid40971826

Structural Information

Molecular Formula
C9H17N5O
SMILES
CCN(CC(C)O)C1=NN=C(C=C1)NN
InChI
InChI=1S/C9H17N5O/c1-3-14(6-7(2)15)9-5-4-8(11-10)12-13-9/h4-5,7,15H,3,6,10H2,1-2H3,(H,11,12)
InChIKey
OWMCFGLDBWRVDZ-UHFFFAOYSA-N
Compound name
1-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

15
Patents

211.14331 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.150586 148.3
[M+Na]+ 234.132528 153.5
[M-H]- 210.136034 148.8
[M+NH4]+ 229.177133 163.2
[M+K]+ 250.106468 152.4
[M+H-H2O]+ 194.140570 139.7
[M+HCOO]- 256.141511 171.0
[M+CH3COO]- 270.157161 196.0
[M+Na-2H]- 232.117976 153.5
[M]+ 211.14276142 146.5
[M]- 211.14385858 146.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe