CID 10219373

N-(but-3-yn-1-yl)hydroxylamine hydrochloride

Structural Information

Molecular Formula
C4H7NO
SMILES
C#CCCNO
InChI
InChI=1S/C4H7NO/c1-2-3-4-5-6/h1,5-6H,3-4H2
InChIKey
QHVFOYQMSXYDOS-UHFFFAOYSA-N
Compound name
N-but-3-ynylhydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

85.052765 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.060041 114.9
[M+Na]+ 108.04198 124.0
[M-H]- 84.045489 113.7
[M+NH4]+ 103.08659 135.4
[M+K]+ 124.01592 122.8
[M+H-H2O]+ 68.050025 104.8
[M+HCOO]- 130.05097 133.5
[M+CH3COO]- 144.06662 173.5
[M+Na-2H]- 106.02743 122.0
[M]+ 85.052216 108.5
[M]- 85.053314 108.5
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

patents stripe