CID 22693546

1-(propan-2-yl)-1h-indazol-6-amine

Structural Information

Molecular Formula

C₁₀H₁₃N₃

SMILES

CC(C)N1C2=C(C=CC(=C2)N)C=N1

InChI

InChI=1S/C10H13N3/c1-7(2)13-10-5-9(11)4-3-8(10)6-12-13/h3-7H,11H2,1-2H3

InChIKey

VIIFGRCMHZRVSF-UHFFFAOYSA-N

Compound name

1-propan-2-ylindazol-6-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 47
Patents: 175.11095 Da
Monoisotopic Mass: 2.1
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]+	176.118226	137.1
[M+Na]+	198.100168	147.4
[M-H]-	174.103674	139.5
[M+NH4]+	193.144773	157.6
[M+K]+	214.074108	144.2
[M+H-H2O]+	158.108210	130.1
[M+HCOO]-	220.109151	160.3
[M+CH3COO]-	234.124801	150.9
[M+Na-2H]-	196.085616	143.2
[M]+	175.11040142	137.9
[M]-	175.11149858	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe