CID 22506

2,2,6,6-tetramethyl-1-nitrosopiperidine

Structural Information

Molecular Formula
C9H18N2O
SMILES
CC1(CCCC(N1N=O)(C)C)C
InChI
InChI=1S/C9H18N2O/c1-8(2)6-5-7-9(3,4)11(8)10-12/h5-7H2,1-4H3
InChIKey
ZBLNPMXAFVVOQK-UHFFFAOYSA-N
Compound name
2,2,6,6-tetramethyl-1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

7
References

40
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 134.2
[M+Na]+ 193.13112 142.1
[M-H]- 169.13462 138.1
[M+NH4]+ 188.17572 158.2
[M+K]+ 209.10506 142.4
[M+H-H2O]+ 153.13916 129.4
[M+HCOO]- 215.14010 156.2
[M+CH3COO]- 229.15575 185.3
[M+Na-2H]- 191.11657 141.6
[M]+ 170.14135 133.8
[M]- 170.14245 133.8
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

patents stripe