CID 15473852

Cyclopentyl nitrite

Structural Information

Molecular Formula
C5H9NO2
SMILES
C1CCC(C1)ON=O
InChI
InChI=1S/C5H9NO2/c7-6-8-5-3-1-2-4-5/h5H,1-4H2
InChIKey
MAEOZYAUPZYZTO-UHFFFAOYSA-N
Compound name
cyclopentyl nitrite
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

115.06333 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 119.9
[M+Na]+ 138.05255 126.5
[M-H]- 114.05605 124.6
[M+NH4]+ 133.09715 144.3
[M+K]+ 154.02649 127.6
[M+H-H2O]+ 98.060590 114.4
[M+HCOO]- 160.06153 146.7
[M+CH3COO]- 174.07718 170.7
[M+Na-2H]- 136.03800 126.8
[M]+ 115.06278 119.4
[M]- 115.06388 119.4
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