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]+ 176.124526 139.9
[M+Na]+ 198.106468 143.9
[M-H]- 174.109974 142.6
[M+NH4]+ 193.151073 149.9
[M+K]+ 214.080408 147.3
[M+H-H2O]+ 158.114510 126.2
[M+HCOO]- 220.115451 155.5
[M+CH3COO]- 234.131101 194.7
[M+Na-2H]- 196.091916 143.4
[M]+ 175.11670142 150.0
[M]- 175.11779858 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.