CID 121207766

1823981-11-8

Structural Information

Molecular Formula
C12H20N2O4
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CNCC2C(=O)O
InChI
InChI=1S/C12H20N2O4/c1-11(2,3)18-10(17)14-6-12(7-14)5-13-4-8(12)9(15)16/h8,13H,4-7H2,1-3H3,(H,15,16)
InChIKey
CJLPPRCRWGZAHJ-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonyl]-2,7-diazaspiro[3.4]octane-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

256.1423 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.149576 162.0
[M+Na]+ 279.131518 165.5
[M-H]- 255.135024 161.9
[M+NH4]+ 274.176123 172.3
[M+K]+ 295.105458 167.1
[M+H-H2O]+ 239.139560 151.9
[M+HCOO]- 301.140501 173.5
[M+CH3COO]- 315.156151 190.5
[M+Na-2H]- 277.116966 162.5
[M]+ 256.14175142 167.6
[M]- 256.14284858 167.6
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

patents stripe