CID 155822829

2567504-69-0

Structural Information

Molecular Formula
C15H25F2NO3
SMILES
CC(C)(C)OC(=O)NC1(CC2(C1)CCC(CC2)(F)F)CO
InChI
InChI=1S/C15H25F2NO3/c1-12(2,3)21-11(20)18-14(10-19)8-13(9-14)4-6-15(16,17)7-5-13/h19H,4-10H2,1-3H3,(H,18,20)
InChIKey
NMGBPPBBUUKEGB-UHFFFAOYSA-N
Compound name
tert-butyl N-[7,7-difluoro-2-(hydroxymethyl)spiro[3.5]nonan-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.18024 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.18752 174.8
[M+Na]+ 328.16946 178.4
[M-H]- 304.17296 175.8
[M+NH4]+ 323.21406 188.4
[M+K]+ 344.14340 179.4
[M+H-H2O]+ 288.17750 165.3
[M+HCOO]- 350.17844 186.7
[M+CH3COO]- 364.19409 204.3
[M+Na-2H]- 326.15491 178.1
[M]+ 305.17969 178.0
[M]- 305.18079 178.0
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.