CID 92327

4-tert-butyl-1-nitrosopiperidine

Structural Information

Molecular Formula
C9H18N2O
SMILES
CC(C)(C)C1CCN(CC1)N=O
InChI
InChI=1S/C9H18N2O/c1-9(2,3)8-4-6-11(10-12)7-5-8/h8H,4-7H2,1-3H3
InChIKey
XVZWACWGVWVKEW-UHFFFAOYSA-N
Compound name
4-tert-butyl-1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

170.1419 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.14918 139.3
[M+Na]+ 193.13112 149.3
[M+NH4]+ 188.17572 147.4
[M+K]+ 209.10506 143.9
[M-H]- 169.13462 140.8
[M+Na-2H]- 191.11657 144.4
[M]+ 170.14135 141.0
[M]- 170.14245 141.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.