CID 12161021

813-216-2

Structural Information

Molecular Formula
C15H15O2P
SMILES
CC1=CC=C(O1)P(C2C=CC=C2)C3=CC=C(O3)C
InChI
InChI=1S/C15H15O2P/c1-11-7-9-14(16-11)18(13-5-3-4-6-13)15-10-8-12(2)17-15/h3-10,13H,1-2H3
InChIKey
BIUFDDGPZSOSAM-UHFFFAOYSA-N
Compound name
cyclopenta-2,4-dien-1-yl-bis(5-methylfuran-2-yl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.08096 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.08824 160.2
[M+Na]+ 281.07018 168.9
[M-H]- 257.07368 171.3
[M+NH4]+ 276.11478 180.0
[M+K]+ 297.04412 168.7
[M+H-H2O]+ 241.07822 153.2
[M+HCOO]- 303.07916 191.5
[M+CH3COO]- 317.09481 195.6
[M+Na-2H]- 279.05563 158.0
[M]+ 258.08041 165.9
[M]- 258.08151 165.9
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.