CID 145874480

2375261-36-0

Structural Information

Molecular Formula
C15H25NO4
SMILES
CC(C)(C)OC(=O)NC1(CC2(C1)CCCCC2)C(=O)O
InChI
InChI=1S/C15H25NO4/c1-13(2,3)20-12(19)16-15(11(17)18)9-14(10-15)7-5-4-6-8-14/h4-10H2,1-3H3,(H,16,19)(H,17,18)
InChIKey
BOERHISUPIBZAP-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonylamino]spiro[3.5]nonane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.17834 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.18562 170.3
[M+Na]+ 306.16756 171.6
[M-H]- 282.17106 173.2
[M+NH4]+ 301.21216 182.3
[M+K]+ 322.14150 174.0
[M+H-H2O]+ 266.17560 161.1
[M+HCOO]- 328.17654 183.6
[M+CH3COO]- 342.19219 200.2
[M+Na-2H]- 304.15301 173.2
[M]+ 283.17779 175.1
[M]- 283.17889 175.1
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.