CID 3316746

18899-64-4

Structural Information

Molecular Formula
C14H16P2
SMILES
C1=CC=C(C=C1)PCCPC2=CC=CC=C2
InChI
InChI=1S/C14H16P2/c1-3-7-13(8-4-1)15-11-12-16-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKey
VBXSERPGINMTDE-UHFFFAOYSA-N
Compound name
phenyl(2-phenylphosphanylethyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

541
Patents

246.07272 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.08000 162.1
[M+Na]+ 269.06194 167.4
[M-H]- 245.06544 165.4
[M+NH4]+ 264.10654 179.8
[M+K]+ 285.03588 163.2
[M+H-H2O]+ 229.06998 149.7
[M+HCOO]- 291.07092 196.1
[M+CH3COO]- 305.08657 196.7
[M+Na-2H]- 267.04739 161.4
[M]+ 246.07217 163.3
[M]- 246.07327 163.3
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