CID 3052839

69352-88-1

Structural Information

Molecular Formula
C9H15NO
SMILES
CC1=CCC(CC1)(C)C(=O)N
InChI
InChI=1S/C9H15NO/c1-7-3-5-9(2,6-4-7)8(10)11/h3H,4-6H2,1-2H3,(H2,10,11)
InChIKey
UFRHTADWHNZOHK-UHFFFAOYSA-N
Compound name
1,4-dimethylcyclohex-3-ene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.122646 133.3
[M+Na]+ 176.104588 139.7
[M-H]- 152.108094 136.4
[M+NH4]+ 171.149193 155.9
[M+K]+ 192.078528 138.5
[M+H-H2O]+ 136.112630 128.7
[M+HCOO]- 198.113571 154.8
[M+CH3COO]- 212.129221 178.8
[M+Na-2H]- 174.090036 138.0
[M]+ 153.11482142 129.4
[M]- 153.11591858 129.4
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.