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

14
Patents

231.14706 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.15434 152.9
[M+Na]+ 254.13628 158.4
[M-H]- 230.13978 154.0
[M+NH4]+ 249.18088 169.8
[M+K]+ 270.11022 159.5
[M+H-H2O]+ 214.14432 147.9
[M+HCOO]- 276.14526 167.4
[M+CH3COO]- 290.16091 185.8
[M+Na-2H]- 252.12173 158.1
[M]+ 231.14651 153.1
[M]- 231.14761 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