CID 139026679

2361635-84-7

Structural Information

Molecular Formula
C8H15N
SMILES
C1CC2(C1)CCC2CN
InChI
InChI=1S/C8H15N/c9-6-7-2-5-8(7)3-1-4-8/h7H,1-6,9H2
InChIKey
BETZWHQPTWVESS-UHFFFAOYSA-N
Compound name
spiro[3.3]heptan-3-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.12045 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 122.0
[M+Na]+ 148.109668 125.9
[M-H]- 124.113174 127.0
[M+NH4]+ 143.154273 132.4
[M+K]+ 164.083608 130.1
[M+H-H2O]+ 108.117710 109.0
[M+HCOO]- 170.118651 141.0
[M+CH3COO]- 184.134301 186.7
[M+Na-2H]- 146.095116 128.2
[M]+ 125.11990142 134.3
[M]- 125.12099858 134.3
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.