CID 19620130

1-(butan-2-yl)-5-cyclopropyl-1h-pyrazol-4-amine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 143.0
[M+Na]+ 202.131458 152.7
[M-H]- 178.134964 147.8
[M+NH4]+ 197.176063 157.3
[M+K]+ 218.105398 148.7
[M+H-H2O]+ 162.139500 135.4
[M+HCOO]- 224.140441 165.3
[M+CH3COO]- 238.156091 188.6
[M+Na-2H]- 200.116906 145.4
[M]+ 179.14169142 144.5
[M]- 179.14278858 144.5
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.