CID 130990732

2174002-00-5

Structural Information

Molecular Formula
C8H15N
SMILES
C=C[C@@H]1CCC[C@H](C1)N
InChI
InChI=1S/C8H15N/c1-2-7-4-3-5-8(9)6-7/h2,7-8H,1,3-6,9H2/t7-,8-/m1/s1
InChIKey
YUFHIVZCQWFSIJ-HTQZYQBOSA-N
Compound name
trans-(1R,3R)-3-ethenylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.12045 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 127.8
[M+Na]+ 148.109668 132.9
[M-H]- 124.113174 130.3
[M+NH4]+ 143.154273 149.5
[M+K]+ 164.083608 131.0
[M+H-H2O]+ 108.117710 122.6
[M+HCOO]- 170.118651 148.9
[M+CH3COO]- 184.134301 173.7
[M+Na-2H]- 146.095116 132.1
[M]+ 125.11990142 120.9
[M]- 125.12099858 120.9
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.