CID 137964272

1,1-difluoro-7-methyl-4-oxaspiro[2.4]heptan-7-amine hydrochloride

Structural Information

Molecular Formula
C7H11F2NO
SMILES
CC1(CCOC12CC2(F)F)N
InChI
InChI=1S/C7H11F2NO/c1-5(10)2-3-11-6(5)4-7(6,8)9/h2-4,10H2,1H3
InChIKey
LXHCNMXXGMVANQ-UHFFFAOYSA-N
Compound name
2,2-difluoro-7-methyl-4-oxaspiro[2.4]heptan-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.08087 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.08815 124.9
[M+Na]+ 186.07009 136.0
[M-H]- 162.07359 130.1
[M+NH4]+ 181.11469 146.7
[M+K]+ 202.04403 136.3
[M+H-H2O]+ 146.07813 121.0
[M+HCOO]- 208.07907 144.3
[M+CH3COO]- 222.09472 180.4
[M+Na-2H]- 184.05554 133.2
[M]+ 163.08032 124.1
[M]- 163.08142 124.1
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.