CID 71305765

1373028-50-2

Structural Information

Molecular Formula
C14H23NO4
SMILES
CC(C)(C)OC(=O)N1CCCC2(CC1)CC2C(=O)O
InChI
InChI=1S/C14H23NO4/c1-13(2,3)19-12(18)15-7-4-5-14(6-8-15)9-10(14)11(16)17/h10H,4-9H2,1-3H3,(H,16,17)
InChIKey
OPAOGOMXWHMOPG-UHFFFAOYSA-N
Compound name
7-[(2-methylpropan-2-yl)oxycarbonyl]-7-azaspiro[2.6]nonane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.16272 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 155.5
[M+Na]+ 292.15194 159.9
[M-H]- 268.15544 159.7
[M+NH4]+ 287.19654 166.6
[M+K]+ 308.12588 162.6
[M+H-H2O]+ 252.15998 150.4
[M+HCOO]- 314.16092 168.7
[M+CH3COO]- 328.17657 197.4
[M+Na-2H]- 290.13739 158.1
[M]+ 269.16217 153.8
[M]- 269.16327 153.8
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.