CID 66662569

851000-71-0

Structural Information

Molecular Formula
C15H21NO3
SMILES
CC(C)(C)OC(=O)N1CCC(C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C15H21NO3/c1-14(2,3)19-13(17)16-10-9-15(18,11-16)12-7-5-4-6-8-12/h4-8,18H,9-11H2,1-3H3
InChIKey
SUVXRTSOZHJSGE-UHFFFAOYSA-N
Compound name
tert-butyl 3-hydroxy-3-phenylpyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

79
Patents

263.15213 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.159406 162.6
[M+Na]+ 286.141348 168.6
[M-H]- 262.144854 166.6
[M+NH4]+ 281.185953 181.0
[M+K]+ 302.115288 166.5
[M+H-H2O]+ 246.149390 156.5
[M+HCOO]- 308.150331 180.1
[M+CH3COO]- 322.165981 190.8
[M+Na-2H]- 284.126796 165.6
[M]+ 263.15158142 161.7
[M]- 263.15267858 161.7
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

patents stripe