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]+ 154.12265 133.3
[M+Na]+ 176.10459 139.7
[M-H]- 152.10809 136.4
[M+NH4]+ 171.14919 155.9
[M+K]+ 192.07853 138.5
[M+H-H2O]+ 136.11263 128.7
[M+HCOO]- 198.11357 154.8
[M+CH3COO]- 212.12922 178.8
[M+Na-2H]- 174.09004 138.0
[M]+ 153.11482 129.4
[M]- 153.11592 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.