CID 3044563

Pyrimidine, 3,4,5,6-tetrahydro-2-(3,4-dimethoxybenzylhydrazino)-, hydrochloride

Structural Information

Molecular Formula
C13H20N4O2
SMILES
COC1=C(C=C(C=C1)CNNC2=NCCCN2)OC
InChI
InChI=1S/C13H20N4O2/c1-18-11-5-4-10(8-12(11)19-2)9-16-17-13-14-6-3-7-15-13/h4-5,8,16H,3,6-7,9H2,1-2H3,(H2,14,15,17)
InChIKey
KFFVZOHRTKXUDJ-UHFFFAOYSA-N
Compound name
1-[(3,4-dimethoxyphenyl)methyl]-2-(1,4,5,6-tetrahydropyrimidin-2-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.15863 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.165906 160.4
[M+Na]+ 287.147848 165.0
[M-H]- 263.151354 162.5
[M+NH4]+ 282.192453 172.8
[M+K]+ 303.121788 161.5
[M+H-H2O]+ 247.155890 150.8
[M+HCOO]- 309.156831 180.6
[M+CH3COO]- 323.172481 198.4
[M+Na-2H]- 285.133296 166.3
[M]+ 264.15808142 157.6
[M]- 264.15917858 157.6
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.