CID 43560372

1-(cyclopropylmethyl)-1h-pyrazol-4-amine

Structural Information

Molecular Formula
C7H11N3
SMILES
C1CC1CN2C=C(C=N2)N
InChI
InChI=1S/C7H11N3/c8-7-3-9-10(5-7)4-6-1-2-6/h3,5-6H,1-2,4,8H2
InChIKey
MHSVYNAOIXCBLJ-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)pyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

137.09529 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.10257 130.5
[M+Na]+ 160.08451 140.8
[M-H]- 136.08801 135.2
[M+NH4]+ 155.12911 146.1
[M+K]+ 176.05845 137.2
[M+H-H2O]+ 120.09255 122.8
[M+HCOO]- 182.09349 154.6
[M+CH3COO]- 196.10914 178.1
[M+Na-2H]- 158.06996 136.1
[M]+ 137.09474 131.1
[M]- 137.09584 131.1
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

patents stripe