CID 494085

Nsc110601

Structural Information

Molecular Formula
C26H24OP
SMILES
C1=CC=C(C=C1)C(CO)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H24OP/c27-21-26(22-13-5-1-6-14-22)28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20,26-27H,21H2/q+1
InChIKey
VVUJXDRCPVPNOE-UHFFFAOYSA-N
Compound name
(2-hydroxy-1-phenylethyl)-triphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

383.15646 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.16374 202.2
[M+Na]+ 406.14568 204.0
[M-H]- 382.14918 210.7
[M+NH4]+ 401.19028 211.0
[M+K]+ 422.11962 191.7
[M+H-H2O]+ 366.15372 191.4
[M+HCOO]- 428.15466 224.6
[M+CH3COO]- 442.17031 211.1
[M+Na-2H]- 404.13113 204.7
[M]+ 383.15591 197.2
[M]- 383.15701 197.2
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.