CID 3064814

1,2-benzenedicarboxamide, n-cyclohexyl-

Structural Information

Molecular Formula
C14H18N2O2
SMILES
C1CCC(CC1)NC(=O)C2=CC=CC=C2C(=O)N
InChI
InChI=1S/C14H18N2O2/c15-13(17)11-8-4-5-9-12(11)14(18)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H2,15,17)(H,16,18)
InChIKey
JUTPABDZLMJBGJ-UHFFFAOYSA-N
Compound name
2-N-cyclohexylbenzene-1,2-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

246.13683 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 156.6
[M+Na]+ 269.12605 159.3
[M-H]- 245.12955 161.7
[M+NH4]+ 264.17065 172.2
[M+K]+ 285.09999 156.6
[M+H-H2O]+ 229.13409 148.9
[M+HCOO]- 291.13503 176.9
[M+CH3COO]- 305.15068 197.1
[M+Na-2H]- 267.11150 158.3
[M]+ 246.13628 149.5
[M]- 246.13738 149.5
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