CID 132327909

[3-(aminomethyl)-4-methylmorpholin-3-yl]methanol

Structural Information

Molecular Formula
C7H16N2O2
SMILES
CN1CCOCC1(CN)CO
InChI
InChI=1S/C7H16N2O2/c1-9-2-3-11-6-7(9,4-8)5-10/h10H,2-6,8H2,1H3
InChIKey
NMYQYBRQAVESCN-UHFFFAOYSA-N
Compound name
[3-(aminomethyl)-4-methylmorpholin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.12119 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.128466 135.6
[M+Na]+ 183.110408 141.3
[M-H]- 159.113914 136.2
[M+NH4]+ 178.155013 154.5
[M+K]+ 199.084348 141.3
[M+H-H2O]+ 143.118450 129.9
[M+HCOO]- 205.119391 153.5
[M+CH3COO]- 219.135041 175.3
[M+Na-2H]- 181.095856 142.0
[M]+ 160.12064142 131.5
[M]- 160.12173858 131.5
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.