CID 63975391

(1-methyl-1h-imidazol-2-yl)(1-phenylcyclopropyl)methanamine hydrochloride

Structural Information

Molecular Formula
C14H17N3
SMILES
CN1C=CN=C1C(C2(CC2)C3=CC=CC=C3)N
InChI
InChI=1S/C14H17N3/c1-17-10-9-16-13(17)12(15)14(7-8-14)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8,15H2,1H3
InChIKey
MRZWKRWGHNCNLH-UHFFFAOYSA-N
Compound name
(1-methylimidazol-2-yl)-(1-phenylcyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.14224 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.14952 152.2
[M+Na]+ 250.13146 161.3
[M-H]- 226.13496 159.7
[M+NH4]+ 245.17606 165.8
[M+K]+ 266.10540 157.1
[M+H-H2O]+ 210.13950 144.3
[M+HCOO]- 272.14044 174.7
[M+CH3COO]- 286.15609 164.2
[M+Na-2H]- 248.11691 156.6
[M]+ 227.14169 152.7
[M]- 227.14279 152.7
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.