CID 145874589

Rac-2-methyl-1-[(1r,2r)-2-phenylcyclopropyl]propan-1-amine

Structural Information

Molecular Formula
C13H19N
SMILES
CC(C)C([C@@H]1C[C@H]1C2=CC=CC=C2)N
InChI
InChI=1S/C13H19N/c1-9(2)13(14)12-8-11(12)10-6-4-3-5-7-10/h3-7,9,11-13H,8,14H2,1-2H3/t11-,12+,13?/m0/s1
InChIKey
MQCSXKTVXVJWAC-LAGVYOHYSA-N
Compound name
2-methyl-1-[(1R,2R)-2-phenylcyclopropyl]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.15175 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 139.5
[M+Na]+ 212.14097 146.7
[M-H]- 188.14447 146.4
[M+NH4]+ 207.18557 154.0
[M+K]+ 228.11491 143.6
[M+H-H2O]+ 172.14901 132.9
[M+HCOO]- 234.14995 162.0
[M+CH3COO]- 248.16560 191.9
[M+Na-2H]- 210.12642 142.8
[M]+ 189.15120 139.6
[M]- 189.15230 139.6
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.