CID 82594919

2470436-15-6

Structural Information

Molecular Formula
C8H13N3
SMILES
CN1C=C(C=N1)C2(CC2)CN
InChI
InChI=1S/C8H13N3/c1-11-5-7(4-10-11)8(6-9)2-3-8/h4-5H,2-3,6,9H2,1H3
InChIKey
XSBSEGAHTXBRNY-UHFFFAOYSA-N
Compound name
[1-(1-methylpyrazol-4-yl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.11095 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.118226 134.6
[M+Na]+ 174.100168 145.2
[M-H]- 150.103674 139.5
[M+NH4]+ 169.144773 151.6
[M+K]+ 190.074108 142.3
[M+H-H2O]+ 134.108210 127.9
[M+HCOO]- 196.109151 158.2
[M+CH3COO]- 210.124801 180.5
[M+Na-2H]- 172.085616 140.8
[M]+ 151.11040142 136.0
[M]- 151.11149858 136.0
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.