CID 3502114

187795-43-3

Structural Information

Molecular Formula
C10H17N3
SMILES
CC(C)(C)N1C(=CC(=N1)C2CC2)N
InChI
InChI=1S/C10H17N3/c1-10(2,3)13-9(11)6-8(12-13)7-4-5-7/h6-7H,4-5,11H2,1-3H3
InChIKey
OTJPHLDPFRTLNZ-UHFFFAOYSA-N
Compound name
1-tert-butyl-3-cyclopropylpyrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

179.14224 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.149516 144.1
[M+Na]+ 202.131458 154.4
[M-H]- 178.134964 149.0
[M+NH4]+ 197.176063 158.6
[M+K]+ 218.105398 150.4
[M+H-H2O]+ 162.139500 137.1
[M+HCOO]- 224.140441 165.7
[M+CH3COO]- 238.156091 187.5
[M+Na-2H]- 200.116906 148.2
[M]+ 179.14169142 145.6
[M]- 179.14278858 145.6
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

patents stripe