CID 135393321

2168618-83-3

Structural Information

Molecular Formula
C11H17NO5
SMILES
CC(C)(C)OC(=O)N1CC2(C1C(=O)O)COC2
InChI
InChI=1S/C11H17NO5/c1-10(2,3)17-9(15)12-4-11(5-16-6-11)7(12)8(13)14/h7H,4-6H2,1-3H3,(H,13,14)
InChIKey
QABAFFXXHIXKRP-UHFFFAOYSA-N
Compound name
6-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxa-6-azaspiro[3.3]heptane-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.11067 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.11795 147.9
[M+Na]+ 266.09989 150.6
[M-H]- 242.10339 151.1
[M+NH4]+ 261.14449 151.1
[M+K]+ 282.07383 157.7
[M+H-H2O]+ 226.10793 134.2
[M+HCOO]- 288.10887 160.0
[M+CH3COO]- 302.12452 199.8
[M+Na-2H]- 264.08534 151.5
[M]+ 243.11012 165.4
[M]- 243.11122 165.4
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.