CID 102909

Brn 1351171

Structural Information

Molecular Formula
C19H30N2O
SMILES
CCC(C)C(CCN1CCCCC1)(C2=CC=CC=C2)C(=O)N
InChI
InChI=1S/C19H30N2O/c1-3-16(2)19(18(20)22,17-10-6-4-7-11-17)12-15-21-13-8-5-9-14-21/h4,6-7,10-11,16H,3,5,8-9,12-15H2,1-2H3,(H2,20,22)
InChIKey
KEZAHVUYFHPESR-UHFFFAOYSA-N
Compound name
3-methyl-2-phenyl-2-(2-piperidin-1-ylethyl)pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.2358 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.24308 177.2
[M+Na]+ 325.22502 177.7
[M-H]- 301.22852 179.7
[M+NH4]+ 320.26962 189.3
[M+K]+ 341.19896 174.1
[M+H-H2O]+ 285.23306 168.3
[M+HCOO]- 347.23400 191.4
[M+CH3COO]- 361.24965 208.2
[M+Na-2H]- 323.21047 177.4
[M]+ 302.23525 171.5
[M]- 302.23635 171.5
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

No patent data available for this compound.