CID 13059952

1,1'-iminobis(3-(cyclopentyloxy)-2-propanol)

Structural Information

Molecular Formula
C16H31NO4
SMILES
C1CCC(C1)OCC(CNCC(COC2CCCC2)O)O
InChI
InChI=1S/C16H31NO4/c18-13(11-20-15-5-1-2-6-15)9-17-10-14(19)12-21-16-7-3-4-8-16/h13-19H,1-12H2
InChIKey
RGTZCVPBHMNGFH-UHFFFAOYSA-N
Compound name
1-cyclopentyloxy-3-[(3-cyclopentyloxy-2-hydroxypropyl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.2253 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.232576 176.0
[M+Na]+ 324.214518 174.4
[M-H]- 300.218024 177.6
[M+NH4]+ 319.259123 191.6
[M+K]+ 340.188458 172.9
[M+H-H2O]+ 284.222560 168.8
[M+HCOO]- 346.223501 192.0
[M+CH3COO]- 360.239151 199.5
[M+Na-2H]- 322.199966 171.8
[M]+ 301.22475142 171.4
[M]- 301.22584858 171.4
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.