CID 10240915

185444-92-2

Structural Information

Molecular Formula

C₅H₉N₃O₂

SMILES

C1C(CN=C(N1)N)C(=O)O

InChI

InChI=1S/C5H9N3O2/c6-5-7-1-3(2-8-5)4(9)10/h3H,1-2H2,(H,9,10)(H3,6,7,8)

InChIKey

PZWMQJZDDYQYGN-UHFFFAOYSA-N

Compound name

2-amino-1,4,5,6-tetrahydropyrimidine-5-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 143.06947 Da
Monoisotopic Mass: -1.8
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]+	144.07675	128.5
[M+Na]+	166.05869	137.3
[M+NH4]+	161.10329	134.6
[M+K]+	182.03263	134.3
[M-H]-	142.06219	127.4
[M+Na-2H]-	164.04414	131.8
[M]+	143.06892	128.9
[M]-	143.07002	128.9

Literature stripe

literature stripe

Patent stripe

patents stripe