CID 13382928

Brn 5591244

Structural Information

Molecular Formula
C14H21N5O
SMILES
C1CCC(C1)/C=N/NC2=NN=C(C=C2)N3CCOCC3
InChI
InChI=1S/C14H21N5O/c1-2-4-12(3-1)11-15-16-13-5-6-14(18-17-13)19-7-9-20-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,16,17)/b15-11+
InChIKey
KJTWLHJSFFNNGS-RVDMUPIBSA-N
Compound name
N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.17462 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.18190 163.3
[M+Na]+ 298.16384 166.0
[M-H]- 274.16734 169.3
[M+NH4]+ 293.20844 174.7
[M+K]+ 314.13778 163.7
[M+H-H2O]+ 258.17188 151.6
[M+HCOO]- 320.17282 181.6
[M+CH3COO]- 334.18847 172.6
[M+Na-2H]- 296.14929 167.3
[M]+ 275.17407 157.0
[M]- 275.17517 157.0
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.