CID 3054407

71293-86-2

Structural Information

Molecular Formula
C15H32NO3P
SMILES
CCCN(CCC)CCOP(=O)(C)OC1CCCCC1
InChI
InChI=1S/C15H32NO3P/c1-4-11-16(12-5-2)13-14-18-20(3,17)19-15-9-7-6-8-10-15/h15H,4-14H2,1-3H3
InChIKey
GGNQCFXZGWKGHQ-UHFFFAOYSA-N
Compound name
N-[2-[cyclohexyloxy(methyl)phosphoryl]oxyethyl]-N-propylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.21198 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.21926 179.1
[M+Na]+ 328.20120 180.1
[M-H]- 304.20470 180.6
[M+NH4]+ 323.24580 194.5
[M+K]+ 344.17514 179.9
[M+H-H2O]+ 288.20924 169.4
[M+HCOO]- 350.21018 203.1
[M+CH3COO]- 364.22583 211.5
[M+Na-2H]- 326.18665 177.8
[M]+ 305.21143 182.0
[M]- 305.21253 182.0
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.