CID 21997974

82857-68-9

Structural Information

Molecular Formula
C23H27ClNP
SMILES
CCN(CC)P(CC1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)Cl
InChI
InChI=1S/C23H27ClNP/c1-3-25(4-2)26(24,22-16-10-6-11-17-22,23-18-12-7-13-19-23)20-21-14-8-5-9-15-21/h5-19H,3-4,20H2,1-2H3
InChIKey
VVSMKQBEDGDJDV-UHFFFAOYSA-N
Compound name
N-(benzyl-chloro-diphenyl-lambda5-phosphanyl)-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

383.15695 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.16423 191.8
[M+Na]+ 406.14617 196.3
[M-H]- 382.14967 200.3
[M+NH4]+ 401.19077 204.5
[M+K]+ 422.12011 189.5
[M+H-H2O]+ 366.15421 180.3
[M+HCOO]- 428.15515 215.4
[M+CH3COO]- 442.17080 224.1
[M+Na-2H]- 404.13162 191.1
[M]+ 383.15640 194.5
[M]- 383.15750 194.5
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