CID 1550757

Cis-1,2,3-triphenylaziridine

Structural Information

Molecular Formula
C20H17N
SMILES
C1=CC=C(C=C1)[C@H]2[C@H](N2C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C20H17N/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)21(19)18-14-8-3-9-15-18/h1-15,19-20H/t19-,20+,21?
InChIKey
BHAJUXABDQWRKH-WCRBZPEASA-N
Compound name
(2S,3R)-1,2,3-triphenylaziridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

271.1361 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.14338 168.7
[M+Na]+ 294.12532 188.2
[M+NH4]+ 289.16992 179.6
[M+K]+ 310.09926 178.6
[M-H]- 270.12882 184.3
[M+Na-2H]- 292.11077 184.7
[M]+ 271.13555 177.5
[M]- 271.13665 177.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe