CID 3020713

Ns00127048

Structural Information

Molecular Formula
C8H11NO
SMILES
C1CC2=C(C1)C(=NO)CC2
InChI
InChI=1S/C8H11NO/c10-9-8-5-4-6-2-1-3-7(6)8/h10H,1-5H2
InChIKey
YSUCYSDBVJYTMF-UHFFFAOYSA-N
Compound name
N-(3,4,5,6-tetrahydro-2H-pentalen-1-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

137.08406 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.091336 127.9
[M+Na]+ 160.073278 135.2
[M-H]- 136.076784 132.4
[M+NH4]+ 155.117883 153.8
[M+K]+ 176.047218 133.5
[M+H-H2O]+ 120.081320 123.1
[M+HCOO]- 182.082261 152.6
[M+CH3COO]- 196.097911 173.3
[M+Na-2H]- 158.058726 132.6
[M]+ 137.08351142 125.1
[M]- 137.08460858 125.1
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

No patent data available for this compound.