CID 15925817

4-(4-nitrophenyl)piperidine hydrochloride

Structural Information

Molecular Formula
C11H14N2O2
SMILES
C1CNCCC1C2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C11H14N2O2/c14-13(15)11-3-1-9(2-4-11)10-5-7-12-8-6-10/h1-4,10,12H,5-8H2
InChIKey
CDSJZBOLNDWPAA-UHFFFAOYSA-N
Compound name
4-(4-nitrophenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

374
Patents

206.10553 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11281 144.2
[M+Na]+ 229.09475 148.1
[M-H]- 205.09825 147.4
[M+NH4]+ 224.13935 159.7
[M+K]+ 245.06869 140.8
[M+H-H2O]+ 189.10279 141.1
[M+HCOO]- 251.10373 163.6
[M+CH3COO]- 265.11938 176.5
[M+Na-2H]- 227.08020 150.8
[M]+ 206.10498 135.9
[M]- 206.10608 135.9
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