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]+ 175.14411 140.3
[M+Na]+ 197.12605 144.4
[M-H]- 173.12955 140.9
[M+NH4]+ 192.17065 158.5
[M+K]+ 213.09999 145.0
[M+H-H2O]+ 157.13409 134.3
[M+HCOO]- 219.13503 157.5
[M+CH3COO]- 233.15068 178.7
[M+Na-2H]- 195.11150 146.7
[M]+ 174.13628 136.6
[M]- 174.13738 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.