CID 3046497

Pyrimido(1,2-a)perimidine, 1,2,3,4,5a,6-hexahydro-4-methyl-

Structural Information

Molecular Formula
C15H15N3
SMILES
CN1CCCN2C1=NC3=CC=CC4=C3C2=CC=C4
InChI
InChI=1S/C15H15N3/c1-17-9-4-10-18-13-8-3-6-11-5-2-7-12(14(11)13)16-15(17)18/h2-3,5-8H,4,9-10H2,1H3
InChIKey
XJXBYIXAVPLGHT-UHFFFAOYSA-N
Compound name
8-methyl-10,11-dihydro-9H-pyrimido[1,2-a]perimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.1266 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.13388 155.1
[M+Na]+ 260.11582 163.5
[M-H]- 236.11932 155.8
[M+NH4]+ 255.16042 171.8
[M+K]+ 276.08976 157.7
[M+H-H2O]+ 220.12386 144.8
[M+HCOO]- 282.12480 168.5
[M+CH3COO]- 296.14045 165.6
[M+Na-2H]- 258.10127 164.1
[M]+ 237.12605 153.1
[M]- 237.12715 153.1
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.