CID 5745582

Alaninamide, n-methyl-n-(alpha-methylphenethyl)-3-phenyl-, l-

Structural Information

Molecular Formula
C19H24N2O
SMILES
C[C@@H](CC1=CC=CC=C1)N(C)C(=O)[C@H](CC2=CC=CC=C2)N
InChI
InChI=1S/C19H24N2O/c1-15(13-16-9-5-3-6-10-16)21(2)19(22)18(20)14-17-11-7-4-8-12-17/h3-12,15,18H,13-14,20H2,1-2H3/t15-,18-/m0/s1
InChIKey
YUUBSCAMHCWZBD-YJBOKZPZSA-N
Compound name
(2S)-2-amino-N-methyl-3-phenyl-N-[(2S)-1-phenylpropan-2-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.196146 174.8
[M+Na]+ 319.178088 177.0
[M-H]- 295.181594 181.2
[M+NH4]+ 314.222693 188.9
[M+K]+ 335.152028 174.5
[M+H-H2O]+ 279.186130 165.8
[M+HCOO]- 341.187071 196.7
[M+CH3COO]- 355.202721 212.8
[M+Na-2H]- 317.163536 175.4
[M]+ 296.18832142 173.2
[M]- 296.18941858 173.2
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.