CID 146082297

2408959-04-4

Structural Information

Molecular Formula
C10H16O3
SMILES
CC(C)(C)OC(=O)C1CC12COC2
InChI
InChI=1S/C10H16O3/c1-9(2,3)13-8(11)7-4-10(7)5-12-6-10/h7H,4-6H2,1-3H3
InChIKey
IQBWKSBKSZKKRD-UHFFFAOYSA-N
Compound name
tert-butyl 5-oxaspiro[2.3]hexane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.10994 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.11722 138.3
[M+Na]+ 207.09916 145.8
[M-H]- 183.10266 145.8
[M+NH4]+ 202.14376 148.6
[M+K]+ 223.07310 149.6
[M+H-H2O]+ 167.10720 129.6
[M+HCOO]- 229.10814 156.4
[M+CH3COO]- 243.12379 187.0
[M+Na-2H]- 205.08461 145.8
[M]+ 184.10939 151.6
[M]- 184.11049 151.6
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.