CID 53301990

51527-97-0

Structural Information

Molecular Formula
C11H17NO3
SMILES
C1=CC(=CC=C1CN(CCO)CCO)O
InChI
InChI=1S/C11H17NO3/c13-7-5-12(6-8-14)9-10-1-3-11(15)4-2-10/h1-4,13-15H,5-9H2
InChIKey
XAVOYDXFXRXRNF-UHFFFAOYSA-N
Compound name
4-[[bis(2-hydroxyethyl)amino]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 147.4
[M+Na]+ 234.11007 152.7
[M-H]- 210.11357 148.1
[M+NH4]+ 229.15467 164.5
[M+K]+ 250.08401 150.6
[M+H-H2O]+ 194.11811 141.2
[M+HCOO]- 256.11905 169.0
[M+CH3COO]- 270.13470 185.2
[M+Na-2H]- 232.09552 151.9
[M]+ 211.12030 147.6
[M]- 211.12140 147.6
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.