CID 126970446

1374654-00-8

Structural Information

Molecular Formula
C11H21NO4
SMILES
CC1(COCCN1C(=O)OC(C)(C)C)CO
InChI
InChI=1S/C11H21NO4/c1-10(2,3)16-9(14)12-5-6-15-8-11(12,4)7-13/h13H,5-8H2,1-4H3
InChIKey
DXNVPQDZAGYXEH-UHFFFAOYSA-N
Compound name
tert-butyl 3-(hydroxymethyl)-3-methylmorpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

231.14706 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.154336 152.9
[M+Na]+ 254.136278 158.4
[M-H]- 230.139784 154.0
[M+NH4]+ 249.180883 169.8
[M+K]+ 270.110218 159.5
[M+H-H2O]+ 214.144320 147.9
[M+HCOO]- 276.145261 167.4
[M+CH3COO]- 290.160911 185.8
[M+Na-2H]- 252.121726 158.1
[M]+ 231.14651142 153.1
[M]- 231.14760858 153.1
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