CID 54594472

Methyl 2-amino-2-methyl-3,3-diphenylpropanoate

Structural Information

Molecular Formula
C17H19NO2
SMILES
CC(C(C1=CC=CC=C1)C2=CC=CC=C2)(C(=O)OC)N
InChI
InChI=1S/C17H19NO2/c1-17(18,16(19)20-2)15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12,15H,18H2,1-2H3
InChIKey
HPBPTLCJOFTQLD-UHFFFAOYSA-N
Compound name
methyl 2-amino-2-methyl-3,3-diphenylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.14157 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.14885 163.9
[M+Na]+ 292.13079 168.5
[M-H]- 268.13429 169.6
[M+NH4]+ 287.17539 179.1
[M+K]+ 308.10473 165.5
[M+H-H2O]+ 252.13883 156.3
[M+HCOO]- 314.13977 184.8
[M+CH3COO]- 328.15542 199.9
[M+Na-2H]- 290.11624 168.1
[M]+ 269.14102 162.7
[M]- 269.14212 162.7
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.