CID 90213225

Tert-butyl 2-[(1s)-1-hydroxyethyl]morpholine-4-carboxylate

Structural Information

Molecular Formula
C11H21NO4
SMILES
C[C@@H](C1CN(CCO1)C(=O)OC(C)(C)C)O
InChI
InChI=1S/C11H21NO4/c1-8(13)9-7-12(5-6-15-9)10(14)16-11(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9?/m0/s1
InChIKey
YISREGIVFNMYSB-IENPIDJESA-N
Compound name
tert-butyl 2-[(1S)-1-hydroxyethyl]morpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

231.14706 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.15434 153.9
[M+Na]+ 254.13628 158.3
[M-H]- 230.13978 154.7
[M+NH4]+ 249.18088 168.7
[M+K]+ 270.11022 159.5
[M+H-H2O]+ 214.14432 148.0
[M+HCOO]- 276.14526 167.4
[M+CH3COO]- 290.16091 187.2
[M+Na-2H]- 252.12173 156.5
[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