CID 137944710

2287236-46-6

Structural Information

Molecular Formula
C11H15N
SMILES
C[C@@H]1C[C@]1(CC2=CC=CC=C2)N
InChI
InChI=1S/C11H15N/c1-9-7-11(9,12)8-10-5-3-2-4-6-10/h2-6,9H,7-8,12H2,1H3/t9-,11-/m1/s1
InChIKey
QREHLINLNAWODX-MWLCHTKSSA-N
Compound name
(1R,2R)-1-benzyl-2-methylcyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.12045 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.12773 136.6
[M+Na]+ 184.10967 150.8
[M+NH4]+ 179.15427 148.2
[M+K]+ 200.08361 143.2
[M-H]- 160.11317 148.3
[M+Na-2H]- 182.09512 148.9
[M]+ 161.11990 143.3
[M]- 161.12100 143.3
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.