CID 77305

Methane, trichloronitroso-

Structural Information

Molecular Formula
CCl3NO
SMILES
C(N=O)(Cl)(Cl)Cl
InChI
InChI=1S/CCl3NO/c2-1(3,4)5-6
InChIKey
WXWITNRAXGTELB-UHFFFAOYSA-N
Compound name
trichloro(nitroso)methane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

146.90454 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.91182 121.4
[M+Na]+ 169.89376 131.8
[M-H]- 145.89726 122.2
[M+NH4]+ 164.93836 144.1
[M+K]+ 185.86770 128.8
[M+H-H2O]+ 129.90180 120.0
[M+HCOO]- 191.90274 132.9
[M+CH3COO]- 205.91839 175.1
[M+Na-2H]- 167.87921 129.7
[M]+ 146.90399 124.2
[M]- 146.90509 124.2
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