CID 202919

Pyrido(2,3-d)pyrimidine, 2,4-diamino-6-propyl-

Structural Information

Molecular Formula

C₁₀H₁₃N₅

SMILES

CCCC1=CC2=C(N=C(N=C2N=C1)N)N

InChI

InChI=1S/C10H13N5/c1-2-3-6-4-7-8(11)14-10(12)15-9(7)13-5-6/h4-5H,2-3H2,1H3,(H4,11,12,13,14,15)

InChIKey

RDRSASQHGFVEFA-UHFFFAOYSA-N

Compound name

6-propylpyrido[2,3-d]pyrimidine-2,4-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 203.1171 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	204.124376	146.4
[M+Na]+	226.106318	156.2
[M-H]-	202.109824	146.6
[M+NH4]+	221.150923	162.1
[M+K]+	242.080258	151.7
[M+H-H2O]+	186.114360	138.0
[M+HCOO]-	248.115301	167.4
[M+CH3COO]-	262.130951	158.2
[M+Na-2H]-	224.091766	154.1
[M]+	203.11655142	144.9
[M]-	203.11764858	144.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe