CID 45008

Brn 2731532

Structural Information

Molecular Formula
C16H24N2O
SMILES
CN(C)C(C1CCCCC1)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C16H24N2O/c1-18(2)15(13-9-5-3-6-10-13)17-16(19)14-11-7-4-8-12-14/h4,7-8,11-13,15H,3,5-6,9-10H2,1-2H3,(H,17,19)
InChIKey
JVIPDFVDUJZREB-UHFFFAOYSA-N
Compound name
N-[cyclohexyl(dimethylamino)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

260.18887 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.19615 163.6
[M+Na]+ 283.17809 164.3
[M-H]- 259.18159 169.8
[M+NH4]+ 278.22269 179.4
[M+K]+ 299.15203 162.9
[M+H-H2O]+ 243.18613 155.1
[M+HCOO]- 305.18707 183.9
[M+CH3COO]- 319.20272 204.6
[M+Na-2H]- 281.16354 165.1
[M]+ 260.18832 158.3
[M]- 260.18942 158.3
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