CID 137951560

2174001-32-0

Structural Information

Molecular Formula
C15H27NO5
SMILES
CC1(CC(CC(O1)(C)C)(C(=O)O)NC(=O)OC(C)(C)C)C
InChI
InChI=1S/C15H27NO5/c1-12(2,3)20-11(19)16-15(10(17)18)8-13(4,5)21-14(6,7)9-15/h8-9H2,1-7H3,(H,16,19)(H,17,18)
InChIKey
PSEYSJWUEGNDLI-UHFFFAOYSA-N
Compound name
2,2,6,6-tetramethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]oxane-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.18893 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.19621 164.3
[M+Na]+ 324.17815 170.1
[M-H]- 300.18165 167.1
[M+NH4]+ 319.22275 183.6
[M+K]+ 340.15209 172.0
[M+H-H2O]+ 284.18619 162.5
[M+HCOO]- 346.18713 179.1
[M+CH3COO]- 360.20278 203.5
[M+Na-2H]- 322.16360 170.1
[M]+ 301.18838 166.6
[M]- 301.18948 166.6
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.