CID 137935277

2248286-87-3

Structural Information

Molecular Formula
C14H23NO5
SMILES
CC(C)(C)OC(=O)N1CC(OCC12CCC2)CC(=O)O
InChI
InChI=1S/C14H23NO5/c1-13(2,3)20-12(18)15-8-10(7-11(16)17)19-9-14(15)5-4-6-14/h10H,4-9H2,1-3H3,(H,16,17)
InChIKey
YMGLFLBAMSWJQP-UHFFFAOYSA-N
Compound name
2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-8-oxa-5-azaspiro[3.5]nonan-7-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.15762 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.164896 164.4
[M+Na]+ 308.146838 166.8
[M-H]- 284.150344 166.8
[M+NH4]+ 303.191443 172.4
[M+K]+ 324.120778 170.8
[M+H-H2O]+ 268.154880 153.7
[M+HCOO]- 330.155821 175.3
[M+CH3COO]- 344.171471 198.7
[M+Na-2H]- 306.132286 167.0
[M]+ 285.15707142 172.1
[M]- 285.15816858 172.1
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.