CID 34176514

801315-74-2

Structural Information

Molecular Formula

C₁₂H₁₅N₃O₂

SMILES

CC(C)(C)OC(=O)N1C2=CC=CC(=C2C=N1)N

InChI

InChI=1S/C12H15N3O2/c1-12(2,3)17-11(16)15-10-6-4-5-9(13)8(10)7-14-15/h4-7H,13H2,1-3H3

InChIKey

LBOHJOLQKZNKFB-UHFFFAOYSA-N

Compound name

tert-butyl 4-aminoindazole-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 50
Patents: 233.11642 Da
Monoisotopic Mass: 2.2
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]+	234.12370	151.5
[M+Na]+	256.10564	162.8
[M+NH4]+	251.15024	158.2
[M+K]+	272.07958	160.2
[M-H]-	232.10914	151.6
[M+Na-2H]-	254.09109	156.4
[M]+	233.11587	152.9
[M]-	233.11697	152.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe