CID 165899776

9,9-difluoro-1-oxaspiro[5.5]undecan-4-amine hydrochloride

Structural Information

Molecular Formula
C10H17F2NO
SMILES
C1COC2(CCC(CC2)(F)F)CC1N
InChI
InChI=1S/C10H17F2NO/c11-10(12)4-2-9(3-5-10)7-8(13)1-6-14-9/h8H,1-7,13H2
InChIKey
JHWIEZGICNBVDZ-UHFFFAOYSA-N
Compound name
9,9-difluoro-1-oxaspiro[5.5]undecan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.12782 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.13510 144.5
[M+Na]+ 228.11704 149.6
[M-H]- 204.12054 146.9
[M+NH4]+ 223.16164 165.6
[M+K]+ 244.09098 148.4
[M+H-H2O]+ 188.12508 137.2
[M+HCOO]- 250.12602 159.0
[M+CH3COO]- 264.14167 184.5
[M+Na-2H]- 226.10249 149.6
[M]+ 205.12727 133.5
[M]- 205.12837 133.5
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.