CID 3033804

105310-41-6

Structural Information

Molecular Formula
C17H26N2O
SMILES
CCCN(CCC)C(=O)[C@@]1(C[C@@H]1CN)C2=CC=CC=C2
InChI
InChI=1S/C17H26N2O/c1-3-10-19(11-4-2)16(20)17(12-15(17)13-18)14-8-6-5-7-9-14/h5-9,15H,3-4,10-13,18H2,1-2H3/t15-,17+/m1/s1
InChIKey
GGRBZIQYFCKSOC-WBVHZDCISA-N
Compound name
(1R,2S)-2-(aminomethyl)-1-phenyl-N,N-dipropylcyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.2045 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.21178 166.5
[M+Na]+ 297.19372 177.8
[M+NH4]+ 292.23832 176.0
[M+K]+ 313.16766 170.9
[M-H]- 273.19722 177.6
[M+Na-2H]- 295.17917 176.5
[M]+ 274.20395 172.4
[M]- 274.20505 172.4
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.