CID 10403433

152706-23-5

Structural Information

Molecular Formula

C₂₂H₂₁NO

SMILES

C1[C@H](N1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CO

InChI

InChI=1S/C22H21NO/c24-17-21-16-23(21)22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21,24H,16-17H2/t21-,23?/m0/s1

InChIKey

YAFYNSAZZKZZSR-BBQAJUCSSA-N

Compound name

[(2S)-1-tritylaziridin-2-yl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 315.16232 Da
Monoisotopic Mass: 4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	316.169596	172.2
[M+Na]+	338.151538	179.2
[M-H]-	314.155044	181.8
[M+NH4]+	333.196143	179.2
[M+K]+	354.125478	173.1
[M+H-H2O]+	298.159580	162.7
[M+HCOO]-	360.160521	192.0
[M+CH3COO]-	374.176171	182.0
[M+Na-2H]-	336.136986	178.5
[M]+	315.16177142	172.0
[M]-	315.16286858	172.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe