CID 137411031

Schembl20644249

Structural Information

Molecular Formula
C9H21NO6
SMILES
C(COCO)N(CCOCO)CCOCO
InChI
InChI=1S/C9H21NO6/c11-7-14-4-1-10(2-5-15-8-12)3-6-16-9-13/h11-13H,1-9H2
InChIKey
ZYIXGJUYCFCKQE-UHFFFAOYSA-N
Compound name
2-[bis[2-(hydroxymethoxy)ethyl]amino]ethoxymethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

239.13689 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.14417 152.7
[M+Na]+ 262.12611 156.1
[M-H]- 238.12961 149.2
[M+NH4]+ 257.17071 168.2
[M+K]+ 278.10005 156.8
[M+H-H2O]+ 222.13415 146.1
[M+HCOO]- 284.13509 173.8
[M+CH3COO]- 298.15074 189.0
[M+Na-2H]- 260.11156 156.3
[M]+ 239.13634 158.4
[M]- 239.13744 158.4
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

patents stripe