CID 4216630

1-(n-(2,6-xylyl)carbamoyl)piperidine

Structural Information

Molecular Formula
C14H20N2O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)N2CCCCC2
InChI
InChI=1S/C14H20N2O/c1-11-7-6-8-12(2)13(11)15-14(17)16-9-4-3-5-10-16/h6-8H,3-5,9-10H2,1-2H3,(H,15,17)
InChIKey
NWIYWNAMZZGUTM-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)piperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

232.15756 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.164836 155.3
[M+Na]+ 255.146778 160.0
[M-H]- 231.150284 159.9
[M+NH4]+ 250.191383 171.5
[M+K]+ 271.120718 157.0
[M+H-H2O]+ 215.154820 147.2
[M+HCOO]- 277.155761 174.6
[M+CH3COO]- 291.171411 193.5
[M+Na-2H]- 253.132226 158.2
[M]+ 232.15701142 150.6
[M]- 232.15810858 150.6
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