CID 146049172

2151890-14-9

Structural Information

Molecular Formula
C26H26N2O2
SMILES
C1COCCN1C(=O)[C@@H]2CN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C26H26N2O2/c29-25(27-16-18-30-19-17-27)24-20-28(24)26(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24H,16-20H2/t24-,28?/m0/s1
InChIKey
RGWGQEKDOACXID-ZZDYIDRTSA-N
Compound name
morpholin-4-yl-[(2S)-1-tritylaziridin-2-yl]methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.19943 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.20671 195.9
[M+Na]+ 421.18865 199.8
[M-H]- 397.19215 207.3
[M+NH4]+ 416.23325 196.5
[M+K]+ 437.16259 195.5
[M+H-H2O]+ 381.19669 183.6
[M+HCOO]- 443.19763 209.8
[M+CH3COO]- 457.21328 202.7
[M+Na-2H]- 419.17410 199.0
[M]+ 398.19888 192.7
[M]- 398.19998 192.7
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.