CID 145867292

2007390-36-3

Structural Information

Molecular Formula
C15H24N2O3
SMILES
CC(C(C1=CC=CC=C1OC)N)NC(=O)OC(C)(C)C
InChI
InChI=1S/C15H24N2O3/c1-10(17-14(18)20-15(2,3)4)13(16)11-8-6-7-9-12(11)19-5/h6-10,13H,16H2,1-5H3,(H,17,18)
InChIKey
GUFIHQIUXBCALK-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-amino-1-(2-methoxyphenyl)propan-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.17868 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.18596 168.7
[M+Na]+ 303.16790 172.6
[M-H]- 279.17140 171.5
[M+NH4]+ 298.21250 183.9
[M+K]+ 319.14184 172.1
[M+H-H2O]+ 263.17594 161.8
[M+HCOO]- 325.17688 189.0
[M+CH3COO]- 339.19253 206.2
[M+Na-2H]- 301.15335 169.7
[M]+ 280.17813 169.6
[M]- 280.17923 169.6
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.