CID 155822093

2503202-43-3

Structural Information

Molecular Formula
C15H25NO4
SMILES
CC(C)(C)OC(=O)NCC1CCC2(CC(C2)C=O)CO1
InChI
InChI=1S/C15H25NO4/c1-14(2,3)20-13(18)16-8-12-4-5-15(10-19-12)6-11(7-15)9-17/h9,11-12H,4-8,10H2,1-3H3,(H,16,18)
InChIKey
MIAUFEPXGKIEQH-UHFFFAOYSA-N
Compound name
tert-butyl N-[(2-formyl-6-oxaspiro[3.5]nonan-7-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.17834 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.185616 164.6
[M+Na]+ 306.167558 166.6
[M-H]- 282.171064 169.5
[M+NH4]+ 301.212163 174.6
[M+K]+ 322.141498 170.1
[M+H-H2O]+ 266.175600 154.0
[M+HCOO]- 328.176541 179.7
[M+CH3COO]- 342.192191 203.3
[M+Na-2H]- 304.153006 168.6
[M]+ 283.17779142 172.4
[M]- 283.17888858 172.4
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.