CID 45791492

1-tert-butyl-4,5,6,7-tetrahydro-1h-indazol-4-amine

Structural Information

Molecular Formula
C11H19N3
SMILES
CC(C)(C)N1C2=C(C=N1)C(CCC2)N
InChI
InChI=1S/C11H19N3/c1-11(2,3)14-10-6-4-5-9(12)8(10)7-13-14/h7,9H,4-6,12H2,1-3H3
InChIKey
CNIAQZASAMBYNA-UHFFFAOYSA-N
Compound name
1-tert-butyl-4,5,6,7-tetrahydroindazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.1579 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.165176 147.1
[M+Na]+ 216.147118 154.6
[M-H]- 192.150624 148.4
[M+NH4]+ 211.191723 166.8
[M+K]+ 232.121058 151.8
[M+H-H2O]+ 176.155160 140.4
[M+HCOO]- 238.156101 164.9
[M+CH3COO]- 252.171751 186.9
[M+Na-2H]- 214.132566 151.4
[M]+ 193.15735142 143.9
[M]- 193.15844858 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.