CID 13696994

1990-22-3

Structural Information

Molecular Formula

C₁₅H₃₃O₃P

SMILES

CCCCCOP(OCCCCC)OCCCCC

InChI

InChI=1S/C15H33O3P/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h4-15H2,1-3H3

InChIKey

CVWUIWZKLYGDNJ-UHFFFAOYSA-N

Compound name

tripentyl phosphite

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4431
Patents: 292.21674 Da
Monoisotopic Mass: 5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	293.22402	182.4
[M+Na]+	315.20596	185.1
[M-H]-	291.20946	179.6
[M+NH4]+	310.25056	198.6
[M+K]+	331.17990	184.1
[M+H-H2O]+	275.21400	173.3
[M+HCOO]-	337.21494	208.0
[M+CH3COO]-	351.23059	208.0
[M+Na-2H]-	313.19141	179.4
[M]+	292.21619	192.5
[M]-	292.21729	192.5

Literature stripe

literature stripe

Patent stripe

patents stripe