CID 53403248

Methyl 6,6-dimethylmorpholine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC1(CNC(CO1)C(=O)OC)C
InChI
InChI=1S/C8H15NO3/c1-8(2)5-9-6(4-12-8)7(10)11-3/h6,9H,4-5H2,1-3H3
InChIKey
HIOMIOFBGFGDHW-UHFFFAOYSA-N
Compound name
methyl 6,6-dimethylmorpholine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

173.1052 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.112476 137.1
[M+Na]+ 196.094418 143.4
[M-H]- 172.097924 138.4
[M+NH4]+ 191.139023 156.1
[M+K]+ 212.068358 144.1
[M+H-H2O]+ 156.102460 131.9
[M+HCOO]- 218.103401 153.8
[M+CH3COO]- 232.119051 175.5
[M+Na-2H]- 194.079866 142.7
[M]+ 173.10465142 135.3
[M]- 173.10574858 135.3
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