CID 16641259

4-(4-morpholinyl)-1-butanol

Structural Information

Molecular Formula
C8H17NO2
SMILES
C1COCCN1CCCCO
InChI
InChI=1S/C8H17NO2/c10-6-2-1-3-9-4-7-11-8-5-9/h10H,1-8H2
InChIKey
URFFPMJFOHTCLI-UHFFFAOYSA-N
Compound name
4-morpholin-4-ylbutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

476
Patents

159.12593 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.133206 136.5
[M+Na]+ 182.115148 140.8
[M-H]- 158.118654 136.8
[M+NH4]+ 177.159753 153.8
[M+K]+ 198.089088 140.8
[M+H-H2O]+ 142.123190 130.0
[M+HCOO]- 204.124131 153.8
[M+CH3COO]- 218.139781 173.3
[M+Na-2H]- 180.100596 142.7
[M]+ 159.12538142 133.9
[M]- 159.12647858 133.9
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