CID 2756802

N-boc-imino-(triphenyl)phosphorane

Structural Information

Molecular Formula
C23H24NO2P
SMILES
CC(C)(C)OC(=O)N=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H24NO2P/c1-23(2,3)26-22(25)24-27(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h4-18H,1-3H3
InChIKey
KNXPVXCUELYHDM-UHFFFAOYSA-N
Compound name
tert-butyl N-(triphenyl-lambda5-phosphanylidene)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

120
Patents

377.15448 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.16176 193.0
[M+Na]+ 400.14370 206.5
[M+NH4]+ 395.18830 200.3
[M+K]+ 416.11764 198.5
[M-H]- 376.14720 199.0
[M+Na-2H]- 398.12915 204.2
[M]+ 377.15393 196.8
[M]- 377.15503 196.8
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

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