CID 118989093

1374654-52-0

Structural Information

Molecular Formula
C11H19NO4
SMILES
CC1(COCCN1C(=O)OC(C)(C)C)C=O
InChI
InChI=1S/C11H19NO4/c1-10(2,3)16-9(14)12-5-6-15-8-11(12,4)7-13/h7H,5-6,8H2,1-4H3
InChIKey
ZNRGBHIYBIVSGT-UHFFFAOYSA-N
Compound name
tert-butyl 3-formyl-3-methylmorpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.13141 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.13869 150.2
[M+Na]+ 252.12063 156.5
[M-H]- 228.12413 152.8
[M+NH4]+ 247.16523 167.8
[M+K]+ 268.09457 157.9
[M+H-H2O]+ 212.12867 145.1
[M+HCOO]- 274.12961 166.4
[M+CH3COO]- 288.14526 187.5
[M+Na-2H]- 250.10608 156.1
[M]+ 229.13086 151.6
[M]- 229.13196 151.6
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.