CID 55290143

4,4-dimethylcyclohex-2-en-1-amine

Structural Information

Molecular Formula
C8H15N
SMILES
CC1(CCC(C=C1)N)C
InChI
InChI=1S/C8H15N/c1-8(2)5-3-7(9)4-6-8/h3,5,7H,4,6,9H2,1-2H3
InChIKey
ZOIFHWVXOKUKEE-UHFFFAOYSA-N
Compound name
4,4-dimethylcyclohex-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

125.12045 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.12773 126.4
[M+Na]+ 148.10967 133.3
[M-H]- 124.11317 129.7
[M+NH4]+ 143.15427 150.4
[M+K]+ 164.08361 132.0
[M+H-H2O]+ 108.11771 122.0
[M+HCOO]- 170.11865 148.9
[M+CH3COO]- 184.13430 173.8
[M+Na-2H]- 146.09512 132.9
[M]+ 125.11990 122.0
[M]- 125.12100 122.0
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

patents stripe