CID 5460713

Dtxsid20423217

Structural Information

Molecular Formula
C4H5As
SMILES
C1=C[AsH]C=C1
InChI
InChI=1S/C4H5As/c1-2-4-5-3-1/h1-5H
InChIKey
NXHAKHHKDBVHPV-UHFFFAOYSA-N
Compound name
1H-arsole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

64
Patents

127.96072 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.96800 119.8
[M+Na]+ 150.94994 127.5
[M-H]- 126.95344 123.1
[M+NH4]+ 145.99454 145.3
[M+K]+ 166.92388 126.8
[M+H-H2O]+ 110.95798 114.6
[M+HCOO]- 172.95892 145.8
[M+CH3COO]- 186.97457 160.8
[M+Na-2H]- 148.93539 127.5
[M]+ 127.96017 118.6
[M]- 127.96127 118.6
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