CID 126838263

{3-[(dimethylamino)methyl]morpholin-3-yl}methanol

Structural Information

Molecular Formula
C8H18N2O2
SMILES
CN(C)CC1(COCCN1)CO
InChI
InChI=1S/C8H18N2O2/c1-10(2)5-8(6-11)7-12-4-3-9-8/h9,11H,3-7H2,1-2H3
InChIKey
XOIWHMSCUOZIFI-UHFFFAOYSA-N
Compound name
[3-[(dimethylamino)methyl]morpholin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.13683 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.144106 140.3
[M+Na]+ 197.126048 144.4
[M-H]- 173.129554 140.9
[M+NH4]+ 192.170653 158.5
[M+K]+ 213.099988 145.0
[M+H-H2O]+ 157.134090 134.3
[M+HCOO]- 219.135031 157.5
[M+CH3COO]- 233.150681 178.7
[M+Na-2H]- 195.111496 146.7
[M]+ 174.13628142 136.6
[M]- 174.13737858 136.6
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.