CID 168356126

9024-15-1

Structural Information

Molecular Formula
C14H25N
SMILES
CC=CC1=C(C(CC(C1(C)C)N)(C)C)C
InChI
InChI=1S/C14H25N/c1-7-8-11-10(2)13(3,4)9-12(15)14(11,5)6/h7-8,12H,9,15H2,1-6H3
InChIKey
LPQSWFPLDCZNCO-UHFFFAOYSA-N
Compound name
2,2,4,5,5-pentamethyl-3-prop-1-enylcyclohex-3-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

456
References

0
Patents

207.1987 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.20598 146.1
[M+Na]+ 230.18792 154.6
[M-H]- 206.19142 150.0
[M+NH4]+ 225.23252 169.9
[M+K]+ 246.16186 151.7
[M+H-H2O]+ 190.19596 142.8
[M+HCOO]- 252.19690 166.8
[M+CH3COO]- 266.21255 193.8
[M+Na-2H]- 228.17337 149.1
[M]+ 207.19815 144.8
[M]- 207.19925 144.8
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.