CID 71655802

1423058-85-8

Structural Information

Molecular Formula
C6H9NO2
SMILES
C1CC=C(C1)C(=O)NO
InChI
InChI=1S/C6H9NO2/c8-6(7-9)5-3-1-2-4-5/h3,9H,1-2,4H2,(H,7,8)
InChIKey
RYYGSXXWQSXKRP-UHFFFAOYSA-N
Compound name
N-hydroxycyclopentene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

64
Patents

127.06333 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.07061 124.9
[M+Na]+ 150.05255 131.1
[M-H]- 126.05605 127.1
[M+NH4]+ 145.09715 147.5
[M+K]+ 166.02649 130.2
[M+H-H2O]+ 110.06059 119.7
[M+HCOO]- 172.06153 148.8
[M+CH3COO]- 186.07718 168.2
[M+Na-2H]- 148.03800 129.9
[M]+ 127.06278 121.6
[M]- 127.06388 121.6
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

patents stripe