CID 10104501

(r)-2-amino-n-benzyl-3-methoxypropionamide

Structural Information

Molecular Formula
C11H16N2O2
SMILES
COC[C@H](C(=O)NCC1=CC=CC=C1)N
InChI
InChI=1S/C11H16N2O2/c1-15-8-10(12)11(14)13-7-9-5-3-2-4-6-9/h2-6,10H,7-8,12H2,1H3,(H,13,14)/t10-/m1/s1
InChIKey
WPLANNRKFDHEKD-SNVBAGLBSA-N
Compound name
(2R)-2-amino-N-benzyl-3-methoxypropanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

157
Patents

208.12119 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 147.8
[M+Na]+ 231.11041 152.3
[M-H]- 207.11391 150.4
[M+NH4]+ 226.15501 165.4
[M+K]+ 247.08435 150.9
[M+H-H2O]+ 191.11845 140.7
[M+HCOO]- 253.11939 171.7
[M+CH3COO]- 267.13504 190.8
[M+Na-2H]- 229.09586 151.8
[M]+ 208.12064 146.6
[M]- 208.12174 146.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe