CID 121553017

Rac-(1r,2r)-2-(1-methyl-1h-imidazol-5-yl)cyclopropan-1-amine dihydrochloride

Structural Information

Molecular Formula
C7H11N3
SMILES
CN1C=NC=C1[C@@H]2C[C@H]2N
InChI
InChI=1S/C7H11N3/c1-10-4-9-3-7(10)5-2-6(5)8/h3-6H,2,8H2,1H3/t5-,6-/m1/s1
InChIKey
OUDIBYCCQHARGQ-PHDIDXHHSA-N
Compound name
(1R,2R)-2-(3-methylimidazol-4-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

137.09529 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.10257 130.7
[M+Na]+ 160.08451 141.9
[M-H]- 136.08801 135.8
[M+NH4]+ 155.12911 146.6
[M+K]+ 176.05845 138.2
[M+H-H2O]+ 120.09255 123.4
[M+HCOO]- 182.09349 154.8
[M+CH3COO]- 196.10914 179.2
[M+Na-2H]- 158.06996 135.6
[M]+ 137.09474 131.7
[M]- 137.09584 131.7
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.