CID 61736984

4-(propan-2-yl)morpholine-2-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC(C)N1CCOC(C1)C(=O)O
InChI
InChI=1S/C8H15NO3/c1-6(2)9-3-4-12-7(5-9)8(10)11/h6-7H,3-5H2,1-2H3,(H,10,11)
InChIKey
NMTRSLHTZCJJBW-UHFFFAOYSA-N
Compound name
4-propan-2-ylmorpholine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

173.1052 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 138.2
[M+Na]+ 196.09442 143.2
[M-H]- 172.09792 139.1
[M+NH4]+ 191.13902 154.9
[M+K]+ 212.06836 144.0
[M+H-H2O]+ 156.10246 132.0
[M+HCOO]- 218.10340 153.8
[M+CH3COO]- 232.11905 177.6
[M+Na-2H]- 194.07987 141.2
[M]+ 173.10465 135.4
[M]- 173.10575 135.4
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