CID 21119039

Ns00065969

Structural Information

Molecular Formula
C10H23NO5
SMILES
CC(C)(CO)N(OCCCO)OCCCO
InChI
InChI=1S/C10H23NO5/c1-10(2,9-14)11(15-7-3-5-12)16-8-4-6-13/h12-14H,3-9H2,1-2H3
InChIKey
RIGDKRZCOJRNHF-UHFFFAOYSA-N
Compound name
2-[bis(3-hydroxypropoxy)amino]-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.15762 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.164896 156.0
[M+Na]+ 260.146838 159.6
[M-H]- 236.150344 152.7
[M+NH4]+ 255.191443 171.9
[M+K]+ 276.120778 159.9
[M+H-H2O]+ 220.154880 150.4
[M+HCOO]- 282.155821 175.0
[M+CH3COO]- 296.171471 190.3
[M+Na-2H]- 258.132286 159.8
[M]+ 237.15707142 160.2
[M]- 237.15816858 160.2
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.