CID 114779672

(4,6,6-trimethylmorpholin-2-yl)methanol hydrochloride

Structural Information

Molecular Formula
C8H17NO2
SMILES
CC1(CN(CC(O1)CO)C)C
InChI
InChI=1S/C8H17NO2/c1-8(2)6-9(3)4-7(5-10)11-8/h7,10H,4-6H2,1-3H3
InChIKey
NOGFNQSWMZUGCI-UHFFFAOYSA-N
Compound name
(4,6,6-trimethylmorpholin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.12593 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.13321 134.5
[M+Na]+ 182.11515 141.7
[M-H]- 158.11865 136.0
[M+NH4]+ 177.15975 154.5
[M+K]+ 198.08909 142.0
[M+H-H2O]+ 142.12319 129.5
[M+HCOO]- 204.12413 151.8
[M+CH3COO]- 218.13978 175.2
[M+Na-2H]- 180.10060 140.6
[M]+ 159.12538 133.0
[M]- 159.12648 133.0
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.