CID 7408247

H-hyp-betana hcl

Structural Information

Molecular Formula
C15H16N2O2
SMILES
C1[C@H](CN[C@@H]1C(=O)NC2=CC3=CC=CC=C3C=C2)O
InChI
InChI=1S/C15H16N2O2/c18-13-8-14(16-9-13)15(19)17-12-6-5-10-3-1-2-4-11(10)7-12/h1-7,13-14,16,18H,8-9H2,(H,17,19)/t13-,14+/m1/s1
InChIKey
RPDYJTXWIGUABB-KGLIPLIRSA-N
Compound name
(2S,4R)-4-hydroxy-N-naphthalen-2-ylpyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

256.1212 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.128476 157.0
[M+Na]+ 279.110418 162.5
[M-H]- 255.113924 160.4
[M+NH4]+ 274.155023 173.4
[M+K]+ 295.084358 157.4
[M+H-H2O]+ 239.118460 149.7
[M+HCOO]- 301.119401 175.2
[M+CH3COO]- 315.135051 167.5
[M+Na-2H]- 277.095866 160.2
[M]+ 256.12065142 151.6
[M]- 256.12174858 151.6
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

patents stripe