CID 5037

Ramifenazone

Structural Information

Molecular Formula

C₁₄H₁₉N₃O

SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(C)C

InChI

InChI=1S/C14H19N3O/c1-10(2)15-13-11(3)16(4)17(14(13)18)12-8-6-5-7-9-12/h5-10,15H,1-4H3

InChIKey

XOZLRRYPUKAKMU-UHFFFAOYSA-N

Compound name

1,5-dimethyl-2-phenyl-4-(propan-2-ylamino)pyrazol-3-one

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 40
References: 3517
Patents: 245.15282 Da
Monoisotopic Mass: 1.6
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]+	246.16010	156.6
[M+Na]+	268.14204	166.0
[M-H]-	244.14554	161.7
[M+NH4]+	263.18664	173.5
[M+K]+	284.11598	162.3
[M+H-H2O]+	228.15008	148.5
[M+HCOO]-	290.15102	179.6
[M+CH3COO]-	304.16667	198.9
[M+Na-2H]-	266.12749	158.5
[M]+	245.15227	158.5
[M]-	245.15337	158.5

Literature stripe

literature stripe

Patent stripe

patents stripe