CID 71305755

1357351-94-0

Structural Information

Molecular Formula
C12H18N2O5
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(=O)NC2C(=O)O
InChI
InChI=1S/C12H18N2O5/c1-11(2,3)19-10(18)14-5-12(6-14)4-7(15)13-8(12)9(16)17/h8H,4-6H2,1-3H3,(H,13,15)(H,16,17)
InChIKey
GACUCUWAYVAYIW-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonyl]-7-oxo-2,6-diazaspiro[3.4]octane-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.12158 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.12886 162.7
[M+Na]+ 293.11080 166.9
[M-H]- 269.11430 162.8
[M+NH4]+ 288.15540 172.4
[M+K]+ 309.08474 168.6
[M+H-H2O]+ 253.11884 152.9
[M+HCOO]- 315.11978 174.4
[M+CH3COO]- 329.13543 193.1
[M+Na-2H]- 291.09625 162.8
[M]+ 270.12103 169.3
[M]- 270.12213 169.3
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.