CID 49987

Bis(2-ethoxyethyl)nitrosoamine

Structural Information

Molecular Formula
C8H18N2O3
SMILES
CCOCCN(CCOCC)N=O
InChI
InChI=1S/C8H18N2O3/c1-3-12-7-5-10(9-11)6-8-13-4-2/h3-8H2,1-2H3
InChIKey
WMLYEFMAENPHOC-UHFFFAOYSA-N
Compound name
N,N-bis(2-ethoxyethyl)nitrous amide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

190.13174 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.13902 142.3
[M+Na]+ 213.12096 147.7
[M-H]- 189.12446 144.9
[M+NH4]+ 208.16556 162.6
[M+K]+ 229.09490 150.0
[M+H-H2O]+ 173.12900 135.6
[M+HCOO]- 235.12994 170.4
[M+CH3COO]- 249.14559 194.2
[M+Na-2H]- 211.10641 148.6
[M]+ 190.13119 149.6
[M]- 190.13229 149.6
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.