CID 155820324

2567504-37-2

Structural Information

Molecular Formula
C14H22O5
SMILES
CC(C)(C)OC(=O)C1CC2(C1)CCC(O2)CC(=O)O
InChI
InChI=1S/C14H22O5/c1-13(2,3)19-12(17)9-7-14(8-9)5-4-10(18-14)6-11(15)16/h9-10H,4-8H2,1-3H3,(H,15,16)
InChIKey
BEJHZPLGWXELBL-UHFFFAOYSA-N
Compound name
2-[2-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxaspiro[3.4]octan-6-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.14673 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.15401 165.0
[M+Na]+ 293.13595 166.6
[M+NH4]+ 288.18055 167.6
[M+K]+ 309.10989 166.5
[M-H]- 269.13945 161.6
[M+Na-2H]- 291.12140 163.6
[M]+ 270.14618 162.8
[M]- 270.14728 162.8
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.