CID 117066584

1-nitroso-2-phenylpyrrolidine

Structural Information

Molecular Formula
C10H12N2O
SMILES
C1CC(N(C1)N=O)C2=CC=CC=C2
InChI
InChI=1S/C10H12N2O/c13-11-12-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
InChIKey
HFXOBJNNUVQCAF-UHFFFAOYSA-N
Compound name
1-nitroso-2-phenylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.09496 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 135.8
[M+Na]+ 199.08418 142.7
[M-H]- 175.08768 142.4
[M+NH4]+ 194.12878 156.5
[M+K]+ 215.05812 141.1
[M+H-H2O]+ 159.09222 128.1
[M+HCOO]- 221.09316 161.1
[M+CH3COO]- 235.10881 182.9
[M+Na-2H]- 197.06963 141.7
[M]+ 176.09441 134.2
[M]- 176.09551 134.2
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.