CID 145913496

2377033-81-1

Structural Information

Molecular Formula
C9H15F2N
SMILES
C1CC2(C1)CC(C2)(CN)C(F)F
InChI
InChI=1S/C9H15F2N/c10-7(11)9(6-12)4-8(5-9)2-1-3-8/h7H,1-6,12H2
InChIKey
PAOOEWCNMYPKFB-UHFFFAOYSA-N
Compound name
[2-(difluoromethyl)spiro[3.3]heptan-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.11725 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.12453 139.9
[M+Na]+ 198.10647 143.9
[M-H]- 174.10997 142.6
[M+NH4]+ 193.15107 149.9
[M+K]+ 214.08041 147.3
[M+H-H2O]+ 158.11451 126.2
[M+HCOO]- 220.11545 155.5
[M+CH3COO]- 234.13110 194.7
[M+Na-2H]- 196.09192 143.4
[M]+ 175.11670 150.0
[M]- 175.11780 150.0
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.