CID 54594815

1-(propan-2-yl)-4,5,6,7-tetrahydro-1h-indazol-6-amine

Structural Information

Molecular Formula
C10H17N3
SMILES
CC(C)N1C2=C(CCC(C2)N)C=N1
InChI
InChI=1S/C10H17N3/c1-7(2)13-10-5-9(11)4-3-8(10)6-12-13/h6-7,9H,3-5,11H2,1-2H3
InChIKey
KYHNEDNGQLMOER-UHFFFAOYSA-N
Compound name
1-propan-2-yl-4,5,6,7-tetrahydroindazol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.14224 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.14952 141.7
[M+Na]+ 202.13146 148.8
[M-H]- 178.13496 142.8
[M+NH4]+ 197.17606 161.7
[M+K]+ 218.10540 146.3
[M+H-H2O]+ 162.13950 134.5
[M+HCOO]- 224.14044 160.5
[M+CH3COO]- 238.15609 185.0
[M+Na-2H]- 200.11691 144.6
[M]+ 179.14169 138.1
[M]- 179.14279 138.1
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.